(3S,5S)-3,5-dibutyl-4-ethenyl-cyclohexan-1-one

Systemtic Name: (3S,5S)-3,5-dibutyl-4-ethenyl-cyclohexan-1-one Openeye Name: (3S,5S)-3,5-dibutyl-4-vinyl-cyclohexanone CAS Name: (3S,5S)-3,5-dibutyl-4-ethenyl-1-cyclohexanone IUPAC Name: (3S,5S)-3,5-dibutyl-4-ethenylcyclohexan-1-one Traditional Name: (3S,5S)-3,5-dibutyl-4-vinyl-cyclohexanone Formula: C16H28O MolecularWeight: 236.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=O)CC(C1C=C)CCCC

Isomeric SMILES

CCCC[C@H]1CC(=O)C[C@@H](C1C=C)CCCC

InChI

InChI=1S/C16H28O/c1-4-7-9-13-11-15(17)12-14(10-8-5-2)16(13)6-3/h6,13-14,16H,3-5,7-12H2,1-2H3/t13-,14-/m0/s1