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CAS 111011-76-8

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2-(benzyl-phenyl-amino)ethyl 5-(5,5-dimethyl-2-oxo-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Description:
The chemical substance known as "2-(benzyl-phenyl-amino)ethyl 5-(5,5-dimethyl-2-oxo-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate," with the CAS number 111011-76-8, is a complex organic compound that features multiple functional groups, including an amino group, a carboxylate, and a nitrophenyl moiety. Its structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals due to the presence of the dihydropyridine core, which is often associated with calcium channel blockers. The phosphacyclohexane component may impart unique properties, such as enhanced stability or bioactivity. The presence of the nitro group indicates potential for further reactivity or interaction with biological targets. Overall, this compound exemplifies the intricate design often found in drug development, where various substituents are strategically incorporated to optimize efficacy and selectivity. Further studies would be necessary to elucidate its specific biological activities and potential therapeutic applications.
Formula:C36H45ClN3O8P
InChI:InChI=1/C34H38N3O7P.C2H6O.ClH/c1-24-30(33(38)42-19-18-36(28-15-9-6-10-16-28)21-26-12-7-5-8-13-26)31(27-14-11-17-29(20-27)37(39)40)32(25(2)35-24)45(41)43-22-34(3,4)23-44-45;1-2-3;/h5-17,20,31,35H,18-19,21-23H2,1-4H3;3H,2H2,1H3;1H
SMILES:CC1=C(C(c2cccc(c2)N(=O)=O)C(=C(C)N1)P1(=O)OCC(C)(C)CO1)C(=O)OCCN(Cc1ccccc1)c1ccccc1.CCO.Cl
Synonyms:
  • Hydrochloride
  • Efonidipine hydrochloride ethanolate
  • Efonidipine hydrochloride ethanol
  • Efonidipine HCl ethanolate
  • Ethanol, compd. with 2-(phenyl(phenylmethyl)amino)ethyl 5-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylate P-oxide monohydrochloride (1:1)
  • Ethanol, compd. with 2-(phenyl(phenylmethyl)amino)ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylate monohydrochloride
  • NZ 105 ethanolate
  • Unii-3Br983K69O
  • 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-4-(3-nitrophenyl)-, 2-(phenyl(phenylmethyl)amino)ethyl ester, P-oxide, monohydrochloride
  • 3-Pyridinecarboxylic acid, 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphorinan-2-yl)-1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-(phenyl(phenylmethyl)amino)ethyl ester, monohydrochloride, compd. with ethanol (1
  • See more synonyms
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