(E)-2-[(E)-2-(4,5-dihydroimidazol-1-yl)octadec-9-en-2-yl]-3-oxidanylidene-icos-11-enal

Systemtic Name: (E)-2-[(E)-2-(4,5-dihydroimidazol-1-yl)octadec-9-en-2-yl]-3-oxidanylidene-icos-11-enal Openeye Name: (E)-2-[(E)-1-(4,5-dihydroimidazol-1-yl)-1-methyl-heptadec-8-enyl]-3-oxo-icos-11-enal CAS Name: (E)-2-[(E)-2-(4,5-dihydroimidazol-1-yl)octadec-9-en-2-yl]-3-oxo-11-eicosenal IUPAC Name: (E)-2-[(E)-2-(4,5-dihydroimidazol-1-yl)octadec-9-en-2-yl]-3-oxoicos-11-enal Traditional Name: (E)-2-[(E)-1-(2-imidazolin-1-yl)-1-methyl-heptadec-8-enyl]-3-keto-eicos-11-enal Formula: C41H74N2O2 MolecularWeight: 627.03846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C(C=O)C(C)(CCCCCCC=CCCCCCCCC)N1CCN=C1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C(C=O)C(C)(CCCCCC/C=C/CCCCCCCC)N1CCN=C1

InChI

InChI=1S/C41H74N2O2/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-40(45)39(37-44)41(3,43-36-35-42-38-43)34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2/h18-20,22,37-39H,4-17,21,23-36H2,1-3H3/b20-18+,22-19+