4-[(2,3-dimethyl-5-sulfamoyl-phenyl)amino]-2,2-diethyl-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2,3-dimethyl-5-sulfamoyl-phenyl)amino]-2,2-diethyl-4-oxidanylidene-butanoate Openeye Name: 4-(2,3-dimethyl-5-sulfamoyl-anilino)-2,2-diethyl-4-oxo-butanoate CAS Name: 4-(2,3-dimethyl-5-sulfamoylanilino)-2,2-diethyl-4-oxobutanoate IUPAC Name: 4-(2,3-dimethyl-5-sulfamoylanilino)-2,2-diethyl-4-oxobutanoate Traditional Name: 4-(2,3-dimethyl-5-sulfamoyl-anilino)-2,2-diethyl-4-keto-butyrate Formula: C16H23N2O5S- MolecularWeight: 355.42922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=C(C(=CC(=C1)S(=O)(=O)N)C)C)C(=O)[O-]

Isomeric SMILES

CCC(CC)(CC(=O)NC1=C(C(=CC(=C1)S(=O)(=O)N)C)C)C(=O)[O-]

InChI

InChI=1S/C16H24N2O5S/c1-5-16(6-2,15(20)21)9-14(19)18-13-8-12(24(17,22)23)7-10(3)11(13)4/h7-8H,5-6,9H2,1-4H3,(H,18,19)(H,20,21)(H2,17,22,23)/p-1