1-methyl-3-(nonoxymethyl)-2-propyl-benzimidazol-1-ium

Systemtic Name: 1-methyl-3-(nonoxymethyl)-2-propyl-benzimidazol-1-ium Openeye Name: 1-methyl-3-(nonoxymethyl)-2-propyl-benzimidazol-1-ium CAS Name: 1-methyl-3-(nonoxymethyl)-2-propylbenzimidazol-1-ium IUPAC Name: 1-methyl-3-(nonoxymethyl)-2-propylbenzimidazol-1-ium Traditional Name: 1-methyl-3-(nonoxymethyl)-2-propyl-benzimidazol-1-ium Formula: C21H35N2O+ MolecularWeight: 331.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1CCC)C

Isomeric SMILES

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1CCC)C

InChI

InChI=1S/C21H35N2O/c1-4-6-7-8-9-10-13-17-24-18-23-20-16-12-11-15-19(20)22(3)21(23)14-5-2/h11-12,15-16H,4-10,13-14,17-18H2,1-3H3/q+1