[3-[(3E,5E,8E)-tetradeca-3,5,8-trien-5-yl]oxiran-2-yl] benzoate

Systemtic Name: [3-[(3E,5E,8E)-tetradeca-3,5,8-trien-5-yl]oxiran-2-yl] benzoate Openeye Name: [3-[(1E,4E)-1-[(E)-but-1-enyl]deca-1,4-dienyl]oxiran-2-yl] benzoate CAS Name: benzoic acid [3-[(3E,5E,8E)-tetradeca-3,5,8-trien-5-yl]-2-oxiranyl] ester IUPAC Name: [3-[(3E,5E,8E)-tetradeca-3,5,8-trien-5-yl]oxiran-2-yl] benzoate Traditional Name: benzoic acid [3-[(1E,4E)-1-[(E)-but-1-enyl]deca-1,4-dienyl]oxiran-2-yl] ester Formula: C23H30O3 MolecularWeight: 354.4825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=C(C=CCC)C1C(O1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC/C=C/C/C=C(\C=C\CC)/C1C(O1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H30O3/c1-3-5-7-8-9-10-12-16-19(15-6-4-2)21-23(25-21)26-22(24)20-17-13-11-14-18-20/h6,9-11,13-18,21,23H,3-5,7-8,12H2,1-2H3/b10-9+,15-6+,19-16+