3-oxidanidyl-3-(1-phenylcyclopropyl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium

Systemtic Name: 3-oxidanidyl-3-(1-phenylcyclopropyl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-oxido-3-(1-phenylcyclopropyl)-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-oxido-3-(1-phenylcyclopropyl)-2-(4-piperidinyl)-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-oxido-3-(1-phenylcyclopropyl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-oxido-3-(1-phenylcyclopropyl)-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2NC3=CC=CC=C3[N+]2(C4(CC4)C5=CC=CC=C5)[O-]

Isomeric SMILES

C1CNCCC1C2NC3=CC=CC=C3[N+]2(C4(CC4)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C21H25N3O/c25-24(21(12-13-21)17-6-2-1-3-7-17)19-9-5-4-8-18(19)23-20(24)16-10-14-22-15-11-16/h1-9,16,20,22-23H,10-15H2