[(2R)-1-oxidanylidene-1-(phenethylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(phenethylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-methyl-benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(phenethylamino)ethyl] 5-(dimethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-methylbenzoic acid [(2R)-1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(phenethylamino)propan-2-yl] 5-(dimethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-methyl-benzoic acid [(1R)-2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C(=O)OC(C)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C(=O)O[C@H](C)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5S/c1-15-10-11-18(29(26,27)23(3)4)14-19(15)21(25)28-16(2)20(24)22-13-12-17-8-6-5-7-9-17/h5-11,14,16H,12-13H2,1-4H3,(H,22,24)/t16-/m1/s1