phenyl 2-(cyclohexylcarbamoyl)-2-(methylsulfonyloxymethyl)-4-phenyl-butanoate

Systemtic Name: phenyl 2-(cyclohexylcarbamoyl)-2-(methylsulfonyloxymethyl)-4-phenyl-butanoate Openeye Name: phenyl 2-(cyclohexylcarbamoyl)-2-(methylsulfonyloxymethyl)-4-phenyl-butanoate CAS Name: 2-[(cyclohexylamino)-oxomethyl]-2-(methylsulfonyloxymethyl)-4-phenylbutanoic acid phenyl ester IUPAC Name: phenyl 2-(cyclohexylcarbamoyl)-2-(methylsulfonyloxymethyl)-4-phenylbutanoate Traditional Name: 2-(cyclohexylcarbamoyl)-2-(methylsulfonyloxymethyl)-4-phenyl-butyric acid phenyl ester Formula: C25H31NO6S MolecularWeight: 473.58174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(CCC1=CC=CC=C1)(C(=O)NC2CCCCC2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OCC(CCC1=CC=CC=C1)(C(=O)NC2CCCCC2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H31NO6S/c1-33(29,30)31-19-25(18-17-20-11-5-2-6-12-20,23(27)26-21-13-7-3-8-14-21)24(28)32-22-15-9-4-10-16-22/h2,4-6,9-12,15-16,21H,3,7-8,13-14,17-19H2,1H3,(H,26,27)