ethyl 1-[[5-(3-ethanoylphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(3-ethanoylphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[5-(3-acetylphenyl)-3-pyridyl]methyl]piperidine-4-carboxylate CAS Name: 1-[[5-(3-acetylphenyl)-3-pyridinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(3-acetylphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[5-(3-acetylphenyl)-3-pyridyl]methyl]isonipecotic acid ethyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=CN=CC(=C2)C3=CC(=CC=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=CN=CC(=C2)C3=CC(=CC=C3)C(=O)C

InChI

InChI=1S/C22H26N2O3/c1-3-27-22(26)18-7-9-24(10-8-18)15-17-11-21(14-23-13-17)20-6-4-5-19(12-20)16(2)25/h4-6,11-14,18H,3,7-10,15H2,1-2H3