[2-(piperidin-1-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] 1-methylindole-3-carboxylate

Systemtic Name: [2-(piperidin-1-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] 1-methylindole-3-carboxylate Openeye Name: [2-(1-piperidylmethyl)quinuclidin-3-yl] 1-methylindole-3-carboxylate CAS Name: 1-methyl-3-indolecarboxylic acid [2-(1-piperidinylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [2-(piperidin-1-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] 1-methylindole-3-carboxylate Traditional Name: 1-methylindole-3-carboxylic acid [2-(piperidinomethyl)quinuclidin-3-yl] ester Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)OC3C4CCN(C3CN5CCCCC5)CC4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)OC3C4CCN(C3CN5CCCCC5)CC4

InChI

InChI=1S/C23H31N3O2/c1-24-15-19(18-7-3-4-8-20(18)24)23(27)28-22-17-9-13-26(14-10-17)21(22)16-25-11-5-2-6-12-25/h3-4,7-8,15,17,21-22H,2,5-6,9-14,16H2,1H3