(3S)-3-(4-ethanoylphenyl)cyclohexan-1-one

Systemtic Name: (3S)-3-(4-ethanoylphenyl)cyclohexan-1-one Openeye Name: (3S)-3-(4-acetylphenyl)cyclohexanone CAS Name: (3S)-3-(4-acetylphenyl)-1-cyclohexanone IUPAC Name: (3S)-3-(4-acetylphenyl)cyclohexan-1-one Traditional Name: (3S)-3-(4-acetylphenyl)cyclohexanone Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2CCCC(=O)C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)[C@H]2CCCC(=O)C2

InChI

InChI=1S/C14H16O2/c1-10(15)11-5-7-12(8-6-11)13-3-2-4-14(16)9-13/h5-8,13H,2-4,9H2,1H3/t13-/m0/s1