2-[(7E,10E)-hexadeca-7,10-dienyl]-3-oxidanylidene-icosanal

Systemtic Name: 2-[(7E,10E)-hexadeca-7,10-dienyl]-3-oxidanylidene-icosanal Openeye Name: 2-[(7E,10E)-hexadeca-7,10-dienyl]-3-oxo-icosanal CAS Name: 2-[(7E,10E)-hexadeca-7,10-dienyl]-3-oxoeicosanal IUPAC Name: 2-[(7E,10E)-hexadeca-7,10-dienyl]-3-oxoicosanal Traditional Name: (9E,12E)-2-stearoyloctadeca-9,12-dienal Formula: C36H66O2 MolecularWeight: 530.90804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCCC=CCC=CCCCCC)C=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCC/C=C/C/C=C/CCCCC)C=O

InChI

InChI=1S/C36H66O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36(38)35(34-37)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,34-35H,3-11,13,15-17,19,21-33H2,1-2H3/b14-12+,20-18+