4-ethyl-2-heptadecyl-3-methyl-4,5-dihydro-1H-imidazol-3-ium; methyl sulfate

Systemtic Name: 4-ethyl-2-heptadecyl-3-methyl-4,5-dihydro-1H-imidazol-3-ium; methyl sulfate Openeye Name: 4-ethyl-2-heptadecyl-3-methyl-4,5-dihydro-1H-imidazol-3-ium; methyl sulfate CAS Name: 4-ethyl-2-heptadecyl-3-methyl-4,5-dihydro-1H-imidazol-3-ium; methyl sulfate IUPAC Name: 4-ethyl-2-heptadecyl-3-methyl-4,5-dihydro-1H-imidazol-3-ium; methyl sulfate Traditional Name: 5-ethyl-2-heptadecyl-1-methyl-2-imidazolin-1-ium; methyl sulfate Formula: C24H50N2O4S MolecularWeight: 462.7298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=[N+](C(CN1)CC)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=[N+](C(CN1)CC)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C23H46N2.CH4O4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-24-21-22(5-2)25(23)3;1-5-6(2,3)4/h22H,4-21H2,1-3H3;1H3,(H,2,3,4)