3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]but-2-en-1-one Openeye Name: 3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]but-2-en-1-one CAS Name: 3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]but-2-en-1-one Traditional Name: 3-methyl-1-[(1R,6S)-2,2,6-trimethylcyclohexyl]but-2-en-1-one Formula: C14H24O MolecularWeight: 208.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C(=O)C=C(C)C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H24O/c1-10(2)9-12(15)13-11(3)7-6-8-14(13,4)5/h9,11,13H,6-8H2,1-5H3/t11-,13-/m0/s1