CAS 1036467-51-2

Formula: C13H8ClNO4S

InChI: InChI=1S/C13H8ClNO4S/c14-8-1-3-9(4-2-8)20-10-5-6-12(15(18)19)11(7-10)13(16)17/h1-7H,(H,16,17)

InChI key: QIDVMNUHAQPBDX-UHFFFAOYSA-N

SMILES: C1=CC(=CC=C1SC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)Cl

5-[(4-Chlorophenyl)sulfanyl]-2-nitrobenzoic acid

CAS: 1036467-51-2

Versatile small molecule scaffold

Formula: C₁₃H₈ClNO₄S

Purity: Min. 95%

Molecular weight: 309.73 g/mol

Ref: 3D-LRB46751