[(1S,3R,4R)-1-cyclohexyl-3-methyl-4-oxidanyl-2-oxidanylidene-4-phenyl-butyl] benzoate

Systemtic Name: [(1S,3R,4R)-1-cyclohexyl-3-methyl-4-oxidanyl-2-oxidanylidene-4-phenyl-butyl] benzoate Openeye Name: [(1S,3R,4R)-1-cyclohexyl-4-hydroxy-3-methyl-2-oxo-4-phenyl-butyl] benzoate CAS Name: benzoic acid [(1S,3R,4R)-1-cyclohexyl-4-hydroxy-3-methyl-2-oxo-4-phenylbutyl] ester IUPAC Name: [(1S,3R,4R)-1-cyclohexyl-4-hydroxy-3-methyl-2-oxo-4-phenylbutyl] benzoate Traditional Name: benzoic acid [(1S,3R,4R)-1-cyclohexyl-4-hydroxy-2-keto-3-methyl-4-phenyl-butyl] ester Formula: C24H28O4 MolecularWeight: 380.47672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)C(=O)C(C2CCCCC2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)O)C(=O)[C@H](C2CCCCC2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H28O4/c1-17(21(25)18-11-5-2-6-12-18)22(26)23(19-13-7-3-8-14-19)28-24(27)20-15-9-4-10-16-20/h2,4-6,9-12,15-17,19,21,23,25H,3,7-8,13-14H2,1H3/t17-,21-,23+/m1/s1