[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-(cyclopropylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-(cyclopropylsulfamoyl)-2-methyl-benzoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 5-(cyclopropylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(cyclopropylsulfamoyl)-2-methylbenzoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 5-(cyclopropylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(cyclopropylsulfamoyl)-2-methyl-benzoic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3CC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3CC3)C)C

InChI

InChI=1S/C21H24N2O5S/c1-13-4-6-17(10-15(13)3)22-20(24)12-28-21(25)19-11-18(9-5-14(19)2)29(26,27)23-16-7-8-16/h4-6,9-11,16,23H,7-8,12H2,1-3H3,(H,22,24)