2-[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-1,1-diphenyl-butan-1-ol chloride

Systemtic Name: 2-[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-1,1-diphenyl-butan-1-ol chloride Openeye Name: 2-[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-1,1-diphenyl-butan-1-ol chloride CAS Name: 2-[1-methyl-3-(nonoxymethyl)-2-benzimidazol-1-iumyl]-1,1-diphenyl-1-butanol chloride IUPAC Name: 2-[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-1,1-diphenylbutan-1-ol chloride Traditional Name: 2-[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-1,1-diphenyl-butan-1-ol chloride Formula: C34H45ClN2O2 MolecularWeight: 549.1863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(CC)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[Cl-]

Isomeric SMILES

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(CC)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[Cl-]

InChI

InChI=1S/C34H45N2O2.ClH/c1-4-6-7-8-9-10-19-26-38-27-36-32-25-18-17-24-31(32)35(3)33(36)30(5-2)34(37,28-20-13-11-14-21-28)29-22-15-12-16-23-29;/h11-18,20-25,30,37H,4-10,19,26-27H2,1-3H3;1H/q+1;/p-1