3-octyl-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: 3-octyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: 3-octyl-5-phenyl-cyclohex-2-en-1-one CAS Name: 3-octyl-5-phenyl-1-cyclohex-2-enone IUPAC Name: 3-octyl-5-phenylcyclohex-2-en-1-one Traditional Name: 3-octyl-5-phenyl-cyclohex-2-en-1-one Formula: C20H28O MolecularWeight: 284.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=O)CC(C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=CC(=O)CC(C1)C2=CC=CC=C2

InChI

InChI=1S/C20H28O/c1-2-3-4-5-6-8-11-17-14-19(16-20(21)15-17)18-12-9-7-10-13-18/h7,9-10,12-13,15,19H,2-6,8,11,14,16H2,1H3