2-[2-[(3-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[(3-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-(3-carboxyanilino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-(3-carboxyanilino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-(3-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(3-carboxyanilino)-2-keto-ethyl]thio]benzoic acid Formula: C16H13NO5S MolecularWeight: 331.34312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCC(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SCC(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H13NO5S/c18-14(17-11-5-3-4-10(8-11)15(19)20)9-23-13-7-2-1-6-12(13)16(21)22/h1-8H,9H2,(H,17,18)(H,19,20)(H,21,22)