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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=CC=CC(=C2N=C1CC3=CC=C(C=C3)C#N)C4CC4)C(C5=CC=CC=N5)O

Isomeric SMILES

C[N+]1(C2=CC=CC(=C2N=C1CC3=CC=C(C=C3)C#N)C4CC4)C(C5=CC=CC=N5)O

InChI

InChI=1S/C25H23N4O/c1-29(25(30)21-6-2-3-14-27-21)22-7-4-5-20(19-12-13-19)24(22)28-23(29)15-17-8-10-18(16-26)11-9-17/h2-11,14,19,25,30H,12-13,15H2,1H3/q+1