[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-phenyl-ethyl] 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [(2R)-1-oxo-1-phenylpropan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-phenylpropan-2-yl] 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [(1R)-2-keto-1-methyl-2-phenyl-ethyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC(C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)O[C@H](C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO6S/c1-15-8-9-18(29(25,26)22-10-12-27-13-11-22)14-19(15)21(24)28-16(2)20(23)17-6-4-3-5-7-17/h3-9,14,16H,10-13H2,1-2H3/t16-/m1/s1