(3-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 1-phenyl-1,3-dihydroisoindole-2-carboxylate

Systemtic Name: (3-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 1-phenyl-1,3-dihydroisoindole-2-carboxylate Openeye Name: (3-methylquinuclidin-1-ium-3-yl) 1-phenylisoindoline-2-carboxylate CAS Name: 1-phenyl-1,3-dihydroisoindole-2-carboxylic acid (3-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester IUPAC Name: (3-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 1-phenyl-1,3-dihydroisoindole-2-carboxylate Traditional Name: 1-phenylisoindoline-2-carboxylic acid (3-methylquinuclidin-1-ium-3-yl) ester Formula: C23H27N2O2+ MolecularWeight: 363.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[NH+]2CCC1CC2)OC(=O)N3CC4=CC=CC=C4C3C5=CC=CC=C5

Isomeric SMILES

CC1(C[NH+]2CCC1CC2)OC(=O)N3CC4=CC=CC=C4C3C5=CC=CC=C5

InChI

InChI=1S/C23H26N2O2/c1-23(16-24-13-11-19(23)12-14-24)27-22(26)25-15-18-9-5-6-10-20(18)21(25)17-7-3-2-4-8-17/h2-10,19,21H,11-16H2,1H3/p+1