[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2)Cl

InChI

InChI=1S/C21H25ClN2O5S/c1-4-24(5-2)30(27,28)19-13-17(11-12-18(19)22)21(26)29-15(3)20(25)23-14-16-9-7-6-8-10-16/h6-13,15H,4-5,14H2,1-3H3,(H,23,25)