methyl 3-[[1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]-propyl-sulfamoyl]benzoate

Systemtic Name: methyl 3-[[1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]-propyl-sulfamoyl]benzoate Openeye Name: methyl 3-[[2-(3-chloroanilino)-1-methyl-2-oxo-ethyl]-propyl-sulfamoyl]benzoate CAS Name: 3-[[1-(3-chloroanilino)-1-oxopropan-2-yl]-propylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(3-chloroanilino)-1-oxopropan-2-yl]-propylsulfamoyl]benzoate Traditional Name: 3-[[2-(3-chloroanilino)-2-keto-1-methyl-ethyl]-propyl-sulfamoyl]benzoic acid methyl ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)C(=O)NC1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CCCN(C(C)C(=O)NC1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C20H23ClN2O5S/c1-4-11-23(14(2)19(24)22-17-9-6-8-16(21)13-17)29(26,27)18-10-5-7-15(12-18)20(25)28-3/h5-10,12-14H,4,11H2,1-3H3,(H,22,24)