ethyl 3-[1-(3-cyanopyridin-2-yl)piperidin-4-yl]-3-(4-fluorophenyl)propanoate

Systemtic Name: ethyl 3-[1-(3-cyanopyridin-2-yl)piperidin-4-yl]-3-(4-fluorophenyl)propanoate Openeye Name: ethyl 3-[1-(3-cyano-2-pyridyl)-4-piperidyl]-3-(4-fluorophenyl)propanoate CAS Name: 3-[1-(3-cyano-2-pyridinyl)-4-piperidinyl]-3-(4-fluorophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(3-cyanopyridin-2-yl)piperidin-4-yl]-3-(4-fluorophenyl)propanoate Traditional Name: 3-[1-(3-cyano-2-pyridyl)-4-piperidyl]-3-(4-fluorophenyl)propionic acid ethyl ester Formula: C22H24FN3O2 MolecularWeight: 381.443263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CCN(CC1)C2=C(C=CC=N2)C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CC(C1CCN(CC1)C2=C(C=CC=N2)C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O2/c1-2-28-21(27)14-20(16-5-7-19(23)8-6-16)17-9-12-26(13-10-17)22-18(15-24)4-3-11-25-22/h3-8,11,17,20H,2,9-10,12-14H2,1H3