[(2E,6E)-3,7-dimethyl-8-oxidanylidene-octa-2,6-dienyl] benzoate

Systemtic Name: [(2E,6E)-3,7-dimethyl-8-oxidanylidene-octa-2,6-dienyl] benzoate Openeye Name: [(2E,6E)-3,7-dimethyl-8-oxo-octa-2,6-dienyl] benzoate CAS Name: benzoic acid [(2E,6E)-3,7-dimethyl-8-oxoocta-2,6-dienyl] ester IUPAC Name: [(2E,6E)-3,7-dimethyl-8-oxoocta-2,6-dienyl] benzoate Traditional Name: benzoic acid [(2E,6E)-8-keto-3,7-dimethyl-octa-2,6-dienyl] ester Formula: C17H20O3 MolecularWeight: 272.3389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1=CC=CC=C1)CCC=C(C)C=O

Isomeric SMILES

C/C(=C\COC(=O)C1=CC=CC=C1)/CC/C=C(\C)/C=O

InChI

InChI=1S/C17H20O3/c1-14(7-6-8-15(2)13-18)11-12-20-17(19)16-9-4-3-5-10-16/h3-5,8-11,13H,6-7,12H2,1-2H3/b14-11+,15-8+