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

Systemtic Name: 3-(1-methylcyclooctyl)-3-oxidanidyl-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-(1-methylcyclooctyl)-3-oxido-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-(1-methylcyclooctyl)-3-oxido-2-(4-piperidinyl)-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-(1-methylcyclooctyl)-3-oxido-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-(1-methylcyclooctyl)-3-oxido-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium Formula: C21H33N3O MolecularWeight: 343.50622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCCCC1)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

Isomeric SMILES

CC1(CCCCCCC1)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

InChI

InChI=1S/C21H33N3O/c1-21(13-7-3-2-4-8-14-21)24(25)19-10-6-5-9-18(19)23-20(24)17-11-15-22-16-12-17/h5-6,9-10,17,20,22-23H,2-4,7-8,11-16H2,1H3