[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: 2-(benzenesulfonamido)-3-methylbutanoic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: 2-(benzenesulfonamido)-3-methyl-butyric acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C25H31NO5S MolecularWeight: 457.58234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)C2CCCCC2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)C2CCCCC2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H31NO5S/c1-18(2)24(26-32(29,30)22-11-7-4-8-12-22)25(28)31-17-23(27)21-15-13-20(14-16-21)19-9-5-3-6-10-19/h4,7-8,11-16,18-19,24,26H,3,5-6,9-10,17H2,1-2H3