3-(dodecoxymethyl)-5-methoxy-1-methyl-benzimidazol-1-ium chloride

Systemtic Name: 3-(dodecoxymethyl)-5-methoxy-1-methyl-benzimidazol-1-ium chloride Openeye Name: 3-(dodecoxymethyl)-5-methoxy-1-methyl-benzimidazol-1-ium chloride CAS Name: 3-(dodecoxymethyl)-5-methoxy-1-methylbenzimidazol-1-ium chloride IUPAC Name: 3-(dodecoxymethyl)-5-methoxy-1-methylbenzimidazol-1-ium chloride Traditional Name: 3-(lauryloxymethyl)-5-methoxy-1-methyl-benzimidazol-1-ium chloride Formula: C22H37ClN2O2 MolecularWeight: 396.99438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCN1C=[N+](C2=C1C=C(C=C2)OC)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOCN1C=[N+](C2=C1C=C(C=C2)OC)C.[Cl-]

InChI

InChI=1S/C22H37N2O2.ClH/c1-4-5-6-7-8-9-10-11-12-13-16-26-19-24-18-23(2)21-15-14-20(25-3)17-22(21)24;/h14-15,17-18H,4-13,16,19H2,1-3H3;1H/q+1;/p-1