2-[(2-carboxyphenyl)amino]-5-methylsulfanyl-benzoic acid

Systemtic Name: 2-[(2-carboxyphenyl)amino]-5-methylsulfanyl-benzoic acid Openeye Name: 2-(2-carboxyanilino)-5-methylsulfanyl-benzoic acid CAS Name: 2-(2-carboxyanilino)-5-(methylthio)benzoic acid IUPAC Name: 2-(2-carboxyanilino)-5-methylsulfanylbenzoic acid Traditional Name: 2-(2-carboxyanilino)-5-(methylthio)benzoic acid Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)NC2=CC=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)NC2=CC=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C15H13NO4S/c1-21-9-6-7-13(11(8-9)15(19)20)16-12-5-3-2-4-10(12)14(17)18/h2-8,16H,1H3,(H,17,18)(H,19,20)