[(2R)-1-[4-(methylsulfonylamino)phenyl]-1-oxidanylidene-propan-2-yl] 4-(diethylamino)benzoate

Systemtic Name: [(2R)-1-[4-(methylsulfonylamino)phenyl]-1-oxidanylidene-propan-2-yl] 4-(diethylamino)benzoate Openeye Name: [(1R)-2-[4-(methanesulfonamido)phenyl]-1-methyl-2-oxo-ethyl] 4-(diethylamino)benzoate CAS Name: 4-(diethylamino)benzoic acid [(2R)-1-[4-(methanesulfonamido)phenyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[4-(methanesulfonamido)phenyl]-1-oxopropan-2-yl] 4-(diethylamino)benzoate Traditional Name: 4-(diethylamino)benzoic acid [(1R)-2-keto-2-[4-(methanesulfonamido)phenyl]-1-methyl-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C21H26N2O5S/c1-5-23(6-2)19-13-9-17(10-14-19)21(25)28-15(3)20(24)16-7-11-18(12-8-16)22-29(4,26)27/h7-15,22H,5-6H2,1-4H3/t15-/m1/s1