4-chloranyl-3-oxidanidyl-3-[1-(1-phenylcycloheptyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium

Systemtic Name: 4-chloranyl-3-oxidanidyl-3-[1-(1-phenylcycloheptyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Openeye Name: 4-chloro-3-oxido-3-[1-(1-phenylcycloheptyl)-4-piperidyl]-1,2-dihydrobenzimidazol-3-ium CAS Name: 4-chloro-3-oxido-3-[1-(1-phenylcycloheptyl)-4-piperidinyl]-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 4-chloro-3-oxido-3-[1-(1-phenylcycloheptyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Traditional Name: 4-chloro-3-oxido-3-[1-(1-phenylcycloheptyl)-4-piperidyl]-1,2-dihydrobenzimidazol-3-ium Formula: C25H32ClN3O MolecularWeight: 425.99408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)[N+]4(CNC5=C4C(=CC=C5)Cl)[O-]

Isomeric SMILES

C1CCCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)[N+]4(CNC5=C4C(=CC=C5)Cl)[O-]

InChI

InChI=1S/C25H32ClN3O/c26-22-11-8-12-23-24(22)29(30,19-27-23)21-13-17-28(18-14-21)25(15-6-1-2-7-16-25)20-9-4-3-5-10-20/h3-5,8-12,21,27H,1-2,6-7,13-19H2