[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(2-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(2-methylphenyl)sulfamoyl]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-(o-tolylsulfamoyl)benzoate CAS Name: 4-[(2-methylphenyl)sulfamoyl]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[(2-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-(o-tolylsulfamoyl)benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C)C(=O)NC3CC3

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)O[C@H](C)C(=O)NC3CC3

InChI

InChI=1S/C20H22N2O5S/c1-13-5-3-4-6-18(13)22-28(25,26)17-11-7-15(8-12-17)20(24)27-14(2)19(23)21-16-9-10-16/h3-8,11-12,14,16,22H,9-10H2,1-2H3,(H,21,23)/t14-/m1/s1