1-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine chloride

Systemtic Name: 1-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine chloride Openeye Name: 1-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine chloride CAS Name: 1-methyl-3-(2-phenoxyethyl)-2-benzimidazol-1-iumamine chloride IUPAC Name: 1-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-amine chloride Traditional Name: [1-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-2-yl]amine chloride Formula: C16H18ClN3O MolecularWeight: 303.78662

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3)N.[Cl-]

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)CCOC3=CC=CC=C3)N.[Cl-]

InChI

InChI=1S/C16H17N3O.ClH/c1-18-14-9-5-6-10-15(14)19(16(18)17)11-12-20-13-7-3-2-4-8-13;/h2-10,17H,11-12H2,1H3;1H