2-(6-methoxy-1-benzofuran-2-yl)-1-methyl-3-(phenylmethyl)benzimidazol-1-ium chloride

Systemtic Name: 2-(6-methoxy-1-benzofuran-2-yl)-1-methyl-3-(phenylmethyl)benzimidazol-1-ium chloride Openeye Name: 1-benzyl-2-(6-methoxybenzofuran-2-yl)-3-methyl-benzimidazol-3-ium chloride CAS Name: 2-(6-methoxy-2-benzofuranyl)-1-methyl-3-(phenylmethyl)benzimidazol-1-ium chloride IUPAC Name: 1-benzyl-2-(6-methoxy-1-benzofuran-2-yl)-3-methylbenzimidazol-3-ium chloride Traditional Name: 1-benzyl-2-(6-methoxybenzofuran-2-yl)-3-methyl-benzimidazol-3-ium chloride Formula: C24H21ClN2O2 MolecularWeight: 404.88874

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC5=C(O4)C=C(C=C5)OC.[Cl-]

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC5=C(O4)C=C(C=C5)OC.[Cl-]

InChI

InChI=1S/C24H21N2O2.ClH/c1-25-20-10-6-7-11-21(20)26(16-17-8-4-3-5-9-17)24(25)23-14-18-12-13-19(27-2)15-22(18)28-23;/h3-15H,16H2,1-2H3;1H/q+1;/p-1