ethyl 3-[4-cyano-4-(2-methoxyphenyl)piperidin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: ethyl 3-[4-cyano-4-(2-methoxyphenyl)piperidin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: ethyl 3-[4-cyano-4-(2-methoxyphenyl)-1-piperidyl]-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-[4-cyano-4-(2-methoxyphenyl)-1-piperidinyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-cyano-4-(2-methoxyphenyl)piperidin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-[4-cyano-4-(2-methoxyphenyl)piperidino]-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC1CC(C2)N3CCC(CC3)(C#N)C4=CC=CC=C4OC

Isomeric SMILES

CCOC(=O)N1C2CCC1CC(C2)N3CCC(CC3)(C#N)C4=CC=CC=C4OC

InChI

InChI=1S/C23H31N3O3/c1-3-29-22(27)26-17-8-9-18(26)15-19(14-17)25-12-10-23(16-24,11-13-25)20-6-4-5-7-21(20)28-2/h4-7,17-19H,3,8-15H2,1-2H3