3-[1-[1-(3-methoxyphenyl)cycloheptyl]piperidin-4-yl]-3-oxidanidyl-1,2-dihydrobenzimidazol-3-ium

Systemtic Name: 3-[1-[1-(3-methoxyphenyl)cycloheptyl]piperidin-4-yl]-3-oxidanidyl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-[1-[1-(3-methoxyphenyl)cycloheptyl]-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-[1-[1-(3-methoxyphenyl)cycloheptyl]-4-piperidinyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-[1-[1-(3-methoxyphenyl)cycloheptyl]piperidin-4-yl]-3-oxido-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-[1-[1-(3-methoxyphenyl)cycloheptyl]-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCCCCC2)N3CCC(CC3)[N+]4(CNC5=CC=CC=C54)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCCCCC2)N3CCC(CC3)[N+]4(CNC5=CC=CC=C54)[O-]

InChI

InChI=1S/C26H35N3O2/c1-31-23-10-8-9-21(19-23)26(15-6-2-3-7-16-26)28-17-13-22(14-18-28)29(30)20-27-24-11-4-5-12-25(24)29/h4-5,8-12,19,22,27H,2-3,6-7,13-18,20H2,1H3