4-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-4-oxobutanoic acid Traditional Name: 4-[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-4-keto-butyric acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C

InChI

InChI=1S/C18H20N2O5S/c1-12-9-13(2)11-15(10-12)20-26(24,25)16-5-3-14(4-6-16)19-17(21)7-8-18(22)23/h3-6,9-11,20H,7-8H2,1-2H3,(H,19,21)(H,22,23)