[(1E,3E)-1-[(1S,2R)-2-methanoylcyclopentyl]trideca-1,3-dien-5-yl] ethanoate

Systemtic Name: [(1E,3E)-1-[(1S,2R)-2-methanoylcyclopentyl]trideca-1,3-dien-5-yl] ethanoate Openeye Name: 1-[(1E,3E)-4-[(1S,2R)-2-formylcyclopentyl]buta-1,3-dienyl]nonyl acetate CAS Name: acetic acid [(1E,3E)-1-[(1S,2R)-2-formylcyclopentyl]trideca-1,3-dien-5-yl] ester IUPAC Name: [(1E,3E)-1-[(1S,2R)-2-formylcyclopentyl]trideca-1,3-dien-5-yl] acetate Traditional Name: acetic acid [(2E,4E)-5-[(1S,2R)-2-formylcyclopentyl]-1-octyl-penta-2,4-dienyl] ester Formula: C21H34O3 MolecularWeight: 334.49286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1CCCC1C=O)OC(=O)C

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/[C@@H]1CCC[C@H]1C=O)OC(=O)C

InChI

InChI=1S/C21H34O3/c1-3-4-5-6-7-8-15-21(24-18(2)23)16-10-9-12-19-13-11-14-20(19)17-22/h9-10,12,16-17,19-21H,3-8,11,13-15H2,1-2H3/b12-9+,16-10+/t19-,20+,21?/m1/s1