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

Systemtic Name: 3-oxidanidyl-3-(1-phenylcyclodecyl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-oxido-3-(1-phenylcyclodecyl)-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-oxido-3-(1-phenylcyclodecyl)-2-(4-piperidinyl)-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-oxido-3-(1-phenylcyclodecyl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-oxido-3-(1-phenylcyclodecyl)-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium Formula: C28H39N3O MolecularWeight: 433.62876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCCC1)(C2=CC=CC=C2)[N+]3(C(NC4=CC=CC=C43)C5CCNCC5)[O-]

Isomeric SMILES

C1CCCCC(CCCC1)(C2=CC=CC=C2)[N+]3(C(NC4=CC=CC=C43)C5CCNCC5)[O-]

InChI

InChI=1S/C28H39N3O/c32-31(26-16-10-9-15-25(26)30-27(31)23-17-21-29-22-18-23)28(24-13-7-6-8-14-24)19-11-4-2-1-3-5-12-20-28/h6-10,13-16,23,27,29-30H,1-5,11-12,17-22H2