[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(diethylsulfamoyl)benzoate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(diethylsulfamoyl)benzoate Openeye Name: [1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 3-(diethylsulfamoyl)benzoate CAS Name: 3-(diethylsulfamoyl)benzoic acid [1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxopropan-2-yl] 3-(diethylsulfamoyl)benzoate Traditional Name: 3-(diethylsulfamoyl)benzoic acid [2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC(=C2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC(=C2)C

InChI

InChI=1S/C21H26N2O5S/c1-5-23(6-2)29(26,27)19-12-8-10-17(14-19)21(25)28-16(4)20(24)22-18-11-7-9-15(3)13-18/h7-14,16H,5-6H2,1-4H3,(H,22,24)