methyl 8-methyl-3-(4-pyridin-4-ylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 8-methyl-3-(4-pyridin-4-ylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 8-methyl-3-[4-(4-pyridyl)phenyl]-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 8-methyl-3-(4-pyridin-4-ylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 8-methyl-3-(4-pyridin-4-ylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 8-methyl-3-[4-(4-pyridyl)phenyl]-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C21H24N2O2 MolecularWeight: 336.42746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)C3=CC=C(C=C3)C4=CC=NC=C4)C(=O)OC

Isomeric SMILES

CN1C2CCC1C(C(C2)C3=CC=C(C=C3)C4=CC=NC=C4)C(=O)OC

InChI

InChI=1S/C21H24N2O2/c1-23-17-7-8-19(23)20(21(24)25-2)18(13-17)16-5-3-14(4-6-16)15-9-11-22-12-10-15/h3-6,9-12,17-20H,7-8,13H2,1-2H3