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

Systemtic Name: 3-oxidanidyl-3-[1-(3-phenylpentan-3-yl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-[1-(1-ethyl-1-phenyl-propyl)-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-oxido-3-[1-(3-phenylpentan-3-yl)-4-piperidinyl]-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-oxido-3-[1-(3-phenylpentan-3-yl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-[1-(1-ethyl-1-phenyl-propyl)-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium Formula: C23H31N3O MolecularWeight: 365.51174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC=CC=C1)N2CCC(CC2)[N+]3(CNC4=CC=CC=C43)[O-]

Isomeric SMILES

CCC(CC)(C1=CC=CC=C1)N2CCC(CC2)[N+]3(CNC4=CC=CC=C43)[O-]

InChI

InChI=1S/C23H31N3O/c1-3-23(4-2,19-10-6-5-7-11-19)25-16-14-20(15-17-25)26(27)18-24-21-12-8-9-13-22(21)26/h5-13,20,24H,3-4,14-18H2,1-2H3