2-[(4-aminophenyl)sulfanylmethyl]benzoic acid

Systemtic Name: 2-[(4-aminophenyl)sulfanylmethyl]benzoic acid Openeye Name: 2-[(4-aminophenyl)sulfanylmethyl]benzoic acid CAS Name: 2-[[(4-aminophenyl)thio]methyl]benzoic acid IUPAC Name: 2-[(4-aminophenyl)sulfanylmethyl]benzoic acid Traditional Name: 2-[[(4-aminophenyl)thio]methyl]benzoic acid Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)N)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)N)C(=O)O

InChI

InChI=1S/C14H13NO2S/c15-11-5-7-12(8-6-11)18-9-10-3-1-2-4-13(10)14(16)17/h1-8H,9,15H2,(H,16,17)