2-[phenylcarbonyl-[4-(sulfomethyl)phenyl]amino]ethanoic acid

Systemtic Name: 2-[phenylcarbonyl-[4-(sulfomethyl)phenyl]amino]ethanoic acid Openeye Name: 2-[N-benzoyl-4-(sulfomethyl)anilino]acetic acid CAS Name: 2-[N-benzoyl-4-(sulfomethyl)anilino]acetic acid IUPAC Name: 2-[N-benzoyl-4-(sulfomethyl)anilino]acetic acid Traditional Name: 2-[N-benzoyl-4-(sulfomethyl)anilino]acetic acid Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO6S/c18-15(19)10-17(16(20)13-4-2-1-3-5-13)14-8-6-12(7-9-14)11-24(21,22)23/h1-9H,10-11H2,(H,18,19)(H,21,22,23)