(12E)-3-[(12E)-4-oxidanylidenehenicosa-1,12-dien-3-yl]oxyhenicosa-1,12-dien-4-one

Systemtic Name: (12E)-3-[(12E)-4-oxidanylidenehenicosa-1,12-dien-3-yl]oxyhenicosa-1,12-dien-4-one Openeye Name: (12E)-3-[(E)-2-oxo-1-vinyl-nonadec-10-enoxy]henicosa-1,12-dien-4-one CAS Name: (12E)-3-[(12E)-4-oxoheneicosa-1,12-dien-3-yl]oxy-4-heneicosa-1,12-dienone IUPAC Name: (12E)-3-[(12E)-4-oxohenicosa-1,12-dien-3-yl]oxyhenicosa-1,12-dien-4-one Traditional Name: (12E)-3-[(E)-2-keto-1-vinyl-nonadec-10-enoxy]heneicosa-1,12-dien-4-one Formula: C42H74O3 MolecularWeight: 627.03516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C(C=C)OC(C=C)C(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C(OC(C(=O)CCCCCCC/C=C/CCCCCCCC)C=C)C=C

InChI

InChI=1S/C42H74O3/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(43)41(7-3)45-42(8-4)40(44)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h7-8,21-24,41-42H,3-6,9-20,25-38H2,1-2H3/b23-21+,24-22+