2-[2-[(4-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-[(4-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-(4-carboxyanilino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-(4-carboxyanilino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(4-carboxyanilino)-2-keto-ethyl]thio]benzoic acid Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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