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

Systemtic Name: (3S)-3-(4-ethanoylphenyl)cycloheptan-1-one Openeye Name: (3S)-3-(4-acetylphenyl)cycloheptanone CAS Name: (3S)-3-(4-acetylphenyl)-1-cycloheptanone IUPAC Name: (3S)-3-(4-acetylphenyl)cycloheptan-1-one Traditional Name: (3S)-3-(4-acetylphenyl)cycloheptanone Formula: C15H18O2 MolecularWeight: 230.30222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2CCCCC(=O)C2

Isomeric SMILES

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

InChI

InChI=1S/C15H18O2/c1-11(16)12-6-8-13(9-7-12)14-4-2-3-5-15(17)10-14/h6-9,14H,2-5,10H2,1H3/t14-/m0/s1