N-[2-(2-heptadecyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]octadecanamide chloride

Systemtic Name: N-[2-(2-heptadecyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]octadecanamide chloride Openeye Name: N-[2-(2-heptadecyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]octadecanamide chloride CAS Name: N-[2-(2-heptadecyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]octadecanamide chloride IUPAC Name: N-[2-(2-heptadecyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]octadecanamide chloride Traditional Name: N-[2-(2-heptadecyl-3-methyl-2-imidazolin-3-ium-1-yl)ethyl]stearamide chloride Formula: C41H82ClN3O MolecularWeight: 668.56228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=[N+](CCN1CCNC(=O)CCCCCCCCCCCCCCCCC)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=[N+](CCN1CCNC(=O)CCCCCCCCCCCCCCCCC)C.[Cl-]

InChI

InChI=1S/C41H81N3O.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40(45)42-36-37-44-39-38-43(3)41(44)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h4-39H2,1-3H3;1H