4-[[1-methyl-1-(1-methyl-2-oxidanyl-2-pyridin-2-yl-cyclopropyl)benzimidazol-1-ium-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[1-methyl-1-(1-methyl-2-oxidanyl-2-pyridin-2-yl-cyclopropyl)benzimidazol-1-ium-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[1-[2-hydroxy-1-methyl-2-(2-pyridyl)cyclopropyl]-1-methyl-benzimidazol-1-ium-2-yl]methyl]benzonitrile CAS Name: 4-[[1-[2-hydroxy-1-methyl-2-(2-pyridinyl)cyclopropyl]-1-methyl-2-benzimidazol-1-iumyl]methyl]benzonitrile IUPAC Name: 4-[[1-(2-hydroxy-1-methyl-2-pyridin-2-ylcyclopropyl)-1-methylbenzimidazol-1-ium-2-yl]methyl]benzonitrile Traditional Name: 4-[[1-[2-hydroxy-1-methyl-2-(2-pyridyl)cyclopropyl]-1-methyl-benzimidazol-1-ium-2-yl]methyl]benzonitrile Formula: C25H23N4O+ MolecularWeight: 395.47632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(C2=CC=CC=N2)O)[N+]3(C4=CC=CC=C4N=C3CC5=CC=C(C=C5)C#N)C

Isomeric SMILES

CC1(CC1(C2=CC=CC=N2)O)[N+]3(C4=CC=CC=C4N=C3CC5=CC=C(C=C5)C#N)C

InChI

InChI=1S/C25H23N4O/c1-24(17-25(24,30)22-9-5-6-14-27-22)29(2)21-8-4-3-7-20(21)28-23(29)15-18-10-12-19(16-26)13-11-18/h3-14,30H,15,17H2,1-2H3/q+1