3-[(3-methylphenyl)sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(3-methylphenyl)sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-(m-tolylsulfonylamino)-4-oxo-butanoic acid CAS Name: 3-[(3-methylphenyl)sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[(3-methylphenyl)sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-(m-tolylsulfonylamino)butyric acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C11H13NO5S/c1-8-3-2-4-10(5-8)18(16,17)12-9(7-13)6-11(14)15/h2-5,7,9,12H,6H2,1H3,(H,14,15)