1-ethyl-3-methyl-2-octadecyl-4,5-dihydroimidazol-3-ium; methyl sulfate; octadecanamide

Systemtic Name: 1-ethyl-3-methyl-2-octadecyl-4,5-dihydroimidazol-3-ium; methyl sulfate; octadecanamide Openeye Name: 1-ethyl-3-methyl-2-octadecyl-4,5-dihydroimidazol-3-ium; methyl sulfate; octadecanamide CAS Name: 1-ethyl-3-methyl-2-octadecyl-4,5-dihydroimidazol-3-ium; methyl sulfate; octadecanamide IUPAC Name: 1-ethyl-3-methyl-2-octadecyl-4,5-dihydroimidazol-3-ium; methyl sulfate; octadecanamide Traditional Name: 1-ethyl-3-methyl-2-stearyl-2-imidazolin-3-ium; methyl sulfate; stearamide Formula: C43H89N3O5S MolecularWeight: 760.24886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=[N+](CCN1CC)C.CCCCCCCCCCCCCCCCCC(=O)N.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=[N+](CCN1CC)C.CCCCCCCCCCCCCCCCCC(=O)N.COS(=O)(=O)[O-]

InChI

InChI=1S/C24H49N2.C18H37NO.CH4O4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-25(3)22-23-26(24)5-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-5-6(2,3)4/h4-23H2,1-3H3;2-17H2,1H3,(H2,19,20);1H3,(H,2,3,4)/q+1;;/p-1