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

Systemtic Name: 3-oxidanidyl-3-(3-phenylpentan-3-yl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-(1-ethyl-1-phenyl-propyl)-3-oxido-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-oxido-3-(3-phenylpentan-3-yl)-2-(4-piperidinyl)-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-oxido-3-(3-phenylpentan-3-yl)-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-(1-ethyl-1-phenyl-propyl)-3-oxido-2-(4-piperidyl)-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)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

Isomeric SMILES

CCC(CC)(C1=CC=CC=C1)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

InChI

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