(E)-N-[(E)-3-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)nonadec-4-enyl]octadec-2-enamide

Systemtic Name: (E)-N-[(E)-3-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)nonadec-4-enyl]octadec-2-enamide Openeye Name: (E)-N-[(E)-3-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)nonadec-4-enyl]octadec-2-enamide CAS Name: (E)-N-[(E)-3-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)nonadec-4-enyl]-2-octadecenamide IUPAC Name: (E)-N-[(E)-3-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)nonadec-4-enyl]octadec-2-enamide Traditional Name: (E)-N-[(E)-3-(1-methyl-2-imidazolin-1-ium-2-yl)nonadec-4-enyl]octadec-2-enamide Formula: C41H78N3O+ MolecularWeight: 629.07752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=CC(=O)NCCC(C=CCCCCCCCCCCCCCC)C1=[N+](CCN1)C

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/C(=O)NCCC(/C=C/CCCCCCCCCCCCCC)C1=[N+](CCN1)C

InChI

InChI=1S/C41H77N3O/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40(45)42-36-35-39(41-43-37-38-44(41)3)33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h31-34,39H,4-30,35-38H2,1-3H3,(H,42,45)/p+1/b33-31+,34-32+