(2S)-2-[(1R)-3-oxidanylidene-1-phenyl-butyl]cyclohexan-1-one

Systemtic Name: (2S)-2-[(1R)-3-oxidanylidene-1-phenyl-butyl]cyclohexan-1-one Openeye Name: (2S)-2-[(1R)-3-oxo-1-phenyl-butyl]cyclohexanone CAS Name: (2S)-2-[(1R)-3-oxo-1-phenylbutyl]-1-cyclohexanone IUPAC Name: (2S)-2-[(1R)-3-oxo-1-phenylbutyl]cyclohexan-1-one Traditional Name: (2S)-2-[(1R)-3-keto-1-phenyl-butyl]cyclohexanone Formula: C16H20O2 MolecularWeight: 244.3288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1CCCCC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C[C@H]([C@@H]1CCCCC1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20O2/c1-12(17)11-15(13-7-3-2-4-8-13)14-9-5-6-10-16(14)18/h2-4,7-8,14-15H,5-6,9-11H2,1H3/t14-,15-/m0/s1