(6,7-diphenyl-4-piperidin-1-yl-2-bicyclo[2.2.2]octanyl) pyridine-3-carboxylate

Systemtic Name: (6,7-diphenyl-4-piperidin-1-yl-2-bicyclo[2.2.2]octanyl) pyridine-3-carboxylate Openeye Name: [6,7-diphenyl-4-(1-piperidyl)-2-bicyclo[2.2.2]octanyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [6,7-diphenyl-4-(1-piperidinyl)-2-bicyclo[2.2.2]octanyl] ester IUPAC Name: (6,7-diphenyl-4-piperidin-1-yl-2-bicyclo[2.2.2]octanyl) pyridine-3-carboxylate Traditional Name: nicotinic acid (6,7-diphenyl-4-piperidino-2-bicyclo[2.2.2]octanyl) ester Formula: C31H34N2O2 MolecularWeight: 466.61386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C23CC(C(C(C2)C4=CC=CC=C4)C(C3)OC(=O)C5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)C23CC(C(C(C2)C4=CC=CC=C4)C(C3)OC(=O)C5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H34N2O2/c34-30(25-15-10-16-32-22-25)35-28-21-31(33-17-8-3-9-18-33)19-26(23-11-4-1-5-12-23)29(28)27(20-31)24-13-6-2-7-14-24/h1-2,4-7,10-16,22,26-29H,3,8-9,17-21H2