[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)-4-chloranyl-benzoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)-4-chloranyl-benzoate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 3-(tert-butylsulfamoyl)-4-chloro-benzoate CAS Name: 3-(tert-butylsulfamoyl)-4-chlorobenzoic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 3-(tert-butylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(tert-butylsulfamoyl)-4-chloro-benzoic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C21H25ClN2O5S/c1-13-8-6-7-9-17(13)23-19(25)14(2)29-20(26)15-10-11-16(22)18(12-15)30(27,28)24-21(3,4)5/h6-12,14,24H,1-5H3,(H,23,25)