[(1E,3E)-1-(3-methanoylphenyl)trideca-1,3-dien-5-yl] ethanoate

Systemtic Name: [(1E,3E)-1-(3-methanoylphenyl)trideca-1,3-dien-5-yl] ethanoate Openeye Name: 1-[(1E,3E)-4-(3-formylphenyl)buta-1,3-dienyl]nonyl acetate CAS Name: acetic acid [(1E,3E)-1-(3-formylphenyl)trideca-1,3-dien-5-yl] ester IUPAC Name: [(1E,3E)-1-(3-formylphenyl)trideca-1,3-dien-5-yl] acetate Traditional Name: acetic acid [(2E,4E)-5-(3-formylphenyl)-1-octyl-penta-2,4-dienyl] ester Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1=CC(=CC=C1)C=O)OC(=O)C

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C1=CC(=CC=C1)C=O)OC(=O)C

InChI

InChI=1S/C22H30O3/c1-3-4-5-6-7-8-15-22(25-19(2)24)16-10-9-12-20-13-11-14-21(17-20)18-23/h9-14,16-18,22H,3-8,15H2,1-2H3/b12-9+,16-10+