1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]but-3-yn-2-one

Systemtic Name: 1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]but-3-yn-2-one Openeye Name: 1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]but-3-yn-2-one CAS Name: 1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]-3-butyn-2-one IUPAC Name: 1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]but-3-yn-2-one Traditional Name: 1-[(1S,2S)-2-[(2E,4E)-6-methylhepta-2,4-dienyl]cyclohexyl]but-3-yn-2-one Formula: C18H26O MolecularWeight: 258.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC=CCC1CCCCC1CC(=O)C#C

Isomeric SMILES

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

InChI

InChI=1S/C18H26O/c1-4-18(19)14-17-13-9-8-12-16(17)11-7-5-6-10-15(2)3/h1,5-7,10,15-17H,8-9,11-14H2,2-3H3/b7-5+,10-6+/t16-,17+/m1/s1