[(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(diethylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(diethylsulfamoyl)benzoate Openeye Name: [(1R)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 2-chloro-5-(diethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] 2-chloro-5-(diethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [(1R)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C21H25ClN2O5S/c1-5-24(6-2)30(27,28)17-11-12-19(22)18(13-17)21(26)29-15(4)20(25)23-16-9-7-14(3)8-10-16/h7-13,15H,5-6H2,1-4H3,(H,23,25)/t15-/m1/s1