ethyl 1-(2,6-dimethoxypyridin-3-yl)carbonyl-3-[(2-fluorophenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-(2,6-dimethoxypyridin-3-yl)carbonyl-3-[(2-fluorophenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(2,6-dimethoxypyridine-3-carbonyl)-3-[(2-fluorophenyl)methyl]piperidine-3-carboxylate CAS Name: 1-[(2,6-dimethoxy-3-pyridinyl)-oxomethyl]-3-[(2-fluorophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,6-dimethoxypyridine-3-carbonyl)-3-[(2-fluorophenyl)methyl]piperidine-3-carboxylate Traditional Name: 1-(2,6-dimethoxynicotinoyl)-3-(2-fluorobenzyl)nipecotic acid ethyl ester Formula: C23H27FN2O5 MolecularWeight: 430.469283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=C(N=C(C=C2)OC)OC)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=C(N=C(C=C2)OC)OC)CC3=CC=CC=C3F

InChI

InChI=1S/C23H27FN2O5/c1-4-31-22(28)23(14-16-8-5-6-9-18(16)24)12-7-13-26(15-23)21(27)17-10-11-19(29-2)25-20(17)30-3/h5-6,8-11H,4,7,12-15H2,1-3H3