[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-(2-methylsulfonylanilino)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(2-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfonylanilino)-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-keto-2-(2-mesylanilino)ethyl] ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NC1=CC=CC=C1S(=O)(=O)C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NC1=CC=CC=C1S(=O)(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C19H21NO5S/c1-14(15-8-4-3-5-9-15)12-19(22)25-13-18(21)20-16-10-6-7-11-17(16)26(2,23)24/h3-11,14H,12-13H2,1-2H3,(H,20,21)/t14-/m1/s1