1-[(1R,2S,3S)-2-ethanoyl-3-phenyl-cyclohexyl]propan-2-one

Systemtic Name: 1-[(1R,2S,3S)-2-ethanoyl-3-phenyl-cyclohexyl]propan-2-one Openeye Name: 1-[(1R,2S,3S)-2-acetyl-3-phenyl-cyclohexyl]propan-2-one CAS Name: 1-[(1R,2S,3S)-2-acetyl-3-phenylcyclohexyl]-2-propanone IUPAC Name: 1-[(1R,2S,3S)-2-acetyl-3-phenylcyclohexyl]propan-2-one Traditional Name: 1-[(1R,2S,3S)-2-acetyl-3-phenyl-cyclohexyl]acetone Formula: C17H22O2 MolecularWeight: 258.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1CCCC(C1C(=O)C)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H22O2/c1-12(18)11-15-9-6-10-16(17(15)13(2)19)14-7-4-3-5-8-14/h3-5,7-8,15-17H,6,9-11H2,1-2H3/t15-,16-,17+/m1/s1