hexadecyl-(1H-imidazol-5-ylmethyl)-dimethyl-azanium chloride hydrochloride

Systemtic Name: hexadecyl-(1H-imidazol-5-ylmethyl)-dimethyl-azanium chloride hydrochloride Openeye Name: hexadecyl-(1H-imidazol-5-ylmethyl)-dimethyl-ammonium chloride hydrochloride CAS Name: hexadecyl-(1H-imidazol-5-ylmethyl)-dimethylammonium chloride hydrochloride IUPAC Name: hexadecyl-(1H-imidazol-5-ylmethyl)-dimethylazanium chloride hydrochloride Traditional Name: cetyl-(1H-imidazol-5-ylmethyl)-dimethyl-ammonium chloride hydrochloride Formula: C22H45Cl2N3 MolecularWeight: 422.5188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CN=CN1.Cl.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CN=CN1.Cl.[Cl-]

InChI

InChI=1S/C22H44N3.2ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(2,3)20-22-19-23-21-24-22;;/h19,21H,4-18,20H2,1-3H3,(H,23,24);2*1H/q+1;;/p-1