[(1E,3E,12E)-octadeca-1,3,12-trienyl] 4-phenylbenzenecarboperoxoate

Systemtic Name: [(1E,3E,12E)-octadeca-1,3,12-trienyl] 4-phenylbenzenecarboperoxoate Openeye Name: [(1E,3E,12E)-octadeca-1,3,12-trienyl] 4-phenylbenzenecarboperoxoate CAS Name: 4-phenylbenzenecarboperoxoic acid [(1E,3E,12E)-octadeca-1,3,12-trienyl] ester IUPAC Name: [(1E,3E,12E)-octadeca-1,3,12-trienyl] 4-phenylbenzenecarboperoxoate Traditional Name: 4-phenylbenzenecarboperoxoic acid [(1E,3E,12E)-octadeca-1,3,12-trienyl] ester Formula: C31H40O3 MolecularWeight: 460.6475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCCCCCCCC=CC=COOC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCC/C=C/CCCCCCC/C=C/C=C/OOC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C31H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27-33-34-31(32)30-25-23-29(24-26-30)28-21-18-17-19-22-28/h6-7,15-27H,2-5,8-14H2,1H3/b7-6+,16-15+,27-20+