4-[(4-methylsulfonylphenyl)amino]-4-oxidanylidene-2-phenyl-butanoic acid

Systemtic Name: 4-[(4-methylsulfonylphenyl)amino]-4-oxidanylidene-2-phenyl-butanoic acid Openeye Name: 4-(4-methylsulfonylanilino)-4-oxo-2-phenyl-butanoic acid CAS Name: 4-(4-methylsulfonylanilino)-4-oxo-2-phenylbutanoic acid IUPAC Name: 4-(4-methylsulfonylanilino)-4-oxo-2-phenylbutanoic acid Traditional Name: 4-keto-4-(4-mesylanilino)-2-phenyl-butyric acid Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5S/c1-24(22,23)14-9-7-13(8-10-14)18-16(19)11-15(17(20)21)12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,18,19)(H,20,21)