5-chloranyl-3-(dodecoxymethyl)-1,2-dimethyl-benzimidazol-1-ium

Systemtic Name: 5-chloranyl-3-(dodecoxymethyl)-1,2-dimethyl-benzimidazol-1-ium Openeye Name: 5-chloro-3-(dodecoxymethyl)-1,2-dimethyl-benzimidazol-1-ium CAS Name: 5-chloro-3-(dodecoxymethyl)-1,2-dimethylbenzimidazol-1-ium IUPAC Name: 5-chloro-3-(dodecoxymethyl)-1,2-dimethylbenzimidazol-1-ium Traditional Name: 5-chloro-3-(lauryloxymethyl)-1,2-dimethyl-benzimidazol-1-ium Formula: C22H36ClN2O+ MolecularWeight: 379.98704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36ClN2O/c1-4-5-6-7-8-9-10-11-12-13-16-26-18-25-19(2)24(3)21-15-14-20(23)17-22(21)25/h14-15,17H,4-13,16,18H2,1-3H3/q+1