(E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-3-ium-4-yl]octadec-9-enamide

Systemtic Name: (E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-3-ium-4-yl]octadec-9-enamide Openeye Name: (E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-3-ium-4-yl]octadec-9-enamide CAS Name: (E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-3-ium-4-yl]-9-octadecenamide IUPAC Name: (E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-3-ium-4-yl]octadec-9-enamide Traditional Name: (E)-N-[3-ethyl-2-[(E)-octadec-9-enyl]-2-imidazolin-3-ium-4-yl]octadec-9-enamide Formula: C41H78N3O+ MolecularWeight: 629.07752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC1=[N+](C(CN1)NC(=O)CCCCCCCC=CCCCCCCCC)CC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC1=[N+](C(CN1)NC(=O)CCCCCCC/C=C/CCCCCCCC)CC

InChI

InChI=1S/C41H77N3O/c1-4-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-39-42-38-40(44(39)6-3)43-41(45)37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-5-2/h19-22,40H,4-18,23-38H2,1-3H3,(H,43,45)/p+1/b21-19+,22-20+