ethyl 1-[[5-(2,5-dimethoxyphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(2,5-dimethoxyphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[5-(2,5-dimethoxyphenyl)-3-pyridyl]methyl]piperidine-4-carboxylate CAS Name: 1-[[5-(2,5-dimethoxyphenyl)-3-pyridinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(2,5-dimethoxyphenyl)pyridin-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[5-(2,5-dimethoxyphenyl)-3-pyridyl]methyl]isonipecotic acid ethyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4/c1-4-28-22(25)17-7-9-24(10-8-17)15-16-11-18(14-23-13-16)20-12-19(26-2)5-6-21(20)27-3/h5-6,11-14,17H,4,7-10,15H2,1-3H3