2-[3-(3-methylphenyl)propanoyl]cyclohexan-1-one

Systemtic Name: 2-[3-(3-methylphenyl)propanoyl]cyclohexan-1-one Openeye Name: 2-[3-(m-tolyl)propanoyl]cyclohexanone CAS Name: 2-[3-(3-methylphenyl)-1-oxopropyl]-1-cyclohexanone IUPAC Name: 2-[3-(3-methylphenyl)propanoyl]cyclohexan-1-one Traditional Name: 2-[3-(m-tolyl)propanoyl]cyclohexanone Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCC(=O)C2CCCCC2=O

Isomeric SMILES

CC1=CC(=CC=C1)CCC(=O)C2CCCCC2=O

InChI

InChI=1S/C16H20O2/c1-12-5-4-6-13(11-12)9-10-16(18)14-7-2-3-8-15(14)17/h4-6,11,14H,2-3,7-10H2,1H3