2-[[carboxymethylsulfanyl(phenyl)methyl]amino]benzoic acid

Systemtic Name: 2-[[carboxymethylsulfanyl(phenyl)methyl]amino]benzoic acid Openeye Name: 2-[[carboxymethylsulfanyl(phenyl)methyl]amino]benzoic acid CAS Name: 2-[[(carboxymethylthio)-phenylmethyl]amino]benzoic acid IUPAC Name: 2-[[carboxymethylsulfanyl(phenyl)methyl]amino]benzoic acid Traditional Name: 2-[[(carboxymethylthio)-phenyl-methyl]amino]benzoic acid Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4S/c18-14(19)10-22-15(11-6-2-1-3-7-11)17-13-9-5-4-8-12(13)16(20)21/h1-9,15,17H,10H2,(H,18,19)(H,20,21)