[(1S,6R)-3-methanoyl-6-(6-methylhepta-1,5-dien-3-yn-2-yl)cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S,6R)-3-methanoyl-6-(6-methylhepta-1,5-dien-3-yn-2-yl)cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S,6R)-3-formyl-6-(5-methyl-1-methylene-hex-4-en-2-ynyl)cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S,6R)-3-formyl-6-(6-methylhepta-1,5-dien-3-yn-2-yl)-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,6R)-3-formyl-6-(6-methylhepta-1,5-dien-3-yn-2-yl)cyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,6R)-3-formyl-6-(5-methyl-1-methylene-hex-4-en-2-ynyl)cyclohex-3-en-1-yl] ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#CC(=C)C1CC=C(CC1OC(=O)C)C=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H20O3/c1-12(2)6-5-7-13(3)16-9-8-15(11-18)10-17(16)20-14(4)19/h6,8,11,16-17H,3,9-10H2,1-2,4H3/t16-,17+/m1/s1