5-cyclopropyl-1-[3-(1-oxidanidylpyridin-1-ium-3-yl)phenyl]benzimidazole

Systemtic Name: 5-cyclopropyl-1-[3-(1-oxidanidylpyridin-1-ium-3-yl)phenyl]benzimidazole Openeye Name: 5-cyclopropyl-1-[3-(1-oxidopyridin-1-ium-3-yl)phenyl]benzimidazole CAS Name: 5-cyclopropyl-1-[3-(1-oxido-3-pyridin-1-iumyl)phenyl]benzimidazole IUPAC Name: 5-cyclopropyl-1-[3-(1-oxidopyridin-1-ium-3-yl)phenyl]benzimidazole Traditional Name: 5-cyclopropyl-1-[3-(1-oxidopyridin-1-ium-3-yl)phenyl]benzimidazole Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC3=C(C=C2)N(C=N3)C4=CC=CC(=C4)C5=C[N+](=CC=C5)[O-]

Isomeric SMILES

C1CC1C2=CC3=C(C=C2)N(C=N3)C4=CC=CC(=C4)C5=C[N+](=CC=C5)[O-]

InChI

InChI=1S/C21H17N3O/c25-23-10-2-4-18(13-23)16-3-1-5-19(11-16)24-14-22-20-12-17(15-6-7-15)8-9-21(20)24/h1-5,8-15H,6-7H2