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

Systemtic Name: 3-[1-(1-ethylcyclohept-4-en-1-yl)piperidin-4-yl]-3-oxidanidyl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-[1-(1-ethylcyclohept-4-en-1-yl)-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-[1-(1-ethyl-1-cyclohept-4-enyl)-4-piperidinyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-[1-(1-ethylcyclohept-4-en-1-yl)piperidin-4-yl]-3-oxido-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-[1-(1-ethylcyclohept-4-en-1-yl)-4-piperidyl]-3-oxido-1,2-dihydrobenzimidazol-3-ium Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC=CCC1)N2CCC(CC2)[N+]3(CNC4=CC=CC=C43)[O-]

Isomeric SMILES

CCC1(CCC=CCC1)N2CCC(CC2)[N+]3(CNC4=CC=CC=C43)[O-]

InChI

InChI=1S/C21H31N3O/c1-2-21(13-7-3-4-8-14-21)23-15-11-18(12-16-23)24(25)17-22-19-9-5-6-10-20(19)24/h3-6,9-10,18,22H,2,7-8,11-17H2,1H3