3-(2-methyl-4-phenyl-butan-2-yl)-3-oxidanidyl-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium

Systemtic Name: 3-(2-methyl-4-phenyl-butan-2-yl)-3-oxidanidyl-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-(1,1-dimethyl-3-phenyl-propyl)-3-oxido-2-(4-piperidyl)-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-(2-methyl-4-phenylbutan-2-yl)-3-oxido-2-(4-piperidinyl)-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-(2-methyl-4-phenylbutan-2-yl)-3-oxido-2-piperidin-4-yl-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-(1,1-dimethyl-3-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:

CC(C)(CCC1=CC=CC=C1)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

Isomeric SMILES

CC(C)(CCC1=CC=CC=C1)[N+]2(C(NC3=CC=CC=C32)C4CCNCC4)[O-]

InChI

InChI=1S/C23H31N3O/c1-23(2,15-12-18-8-4-3-5-9-18)26(27)21-11-7-6-10-20(21)25-22(26)19-13-16-24-17-14-19/h3-11,19,22,24-25H,12-17H2,1-2H3