[(1E,12E)-octadeca-1,12-dienyl] benzenecarboperoxoate

Systemtic Name: [(1E,12E)-octadeca-1,12-dienyl] benzenecarboperoxoate Openeye Name: [(1E,12E)-octadeca-1,12-dienyl] benzenecarboperoxoate CAS Name: benzenecarboperoxoic acid [(1E,12E)-octadeca-1,12-dienyl] ester IUPAC Name: [(1E,12E)-octadeca-1,12-dienyl] benzenecarboperoxoate Traditional Name: benzenecarboperoxoic acid [(1E,12E)-octadeca-1,12-dienyl] ester Formula: C25H38O3 MolecularWeight: 386.56742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCCCCCCCCCC=COOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC/C=C/CCCCCCCCC/C=C/OOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C25H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-28-25(26)24-21-18-17-19-22-24/h6-7,17-23H,2-5,8-16H2,1H3/b7-6+,23-20+