ethyl 3-(4-fluorophenyl)-3-[1-(5-propan-2-yl-1-pyridin-2-yl-pyrazol-4-yl)carbonylpiperidin-4-yl]propanoate

Systemtic Name: ethyl 3-(4-fluorophenyl)-3-[1-(5-propan-2-yl-1-pyridin-2-yl-pyrazol-4-yl)carbonylpiperidin-4-yl]propanoate Openeye Name: ethyl 3-(4-fluorophenyl)-3-[1-[5-isopropyl-1-(2-pyridyl)pyrazole-4-carbonyl]-4-piperidyl]propanoate CAS Name: 3-(4-fluorophenyl)-3-[1-[oxo-[5-propan-2-yl-1-(2-pyridinyl)-4-pyrazolyl]methyl]-4-piperidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-3-[1-(5-propan-2-yl-1-pyridin-2-ylpyrazole-4-carbonyl)piperidin-4-yl]propanoate Traditional Name: 3-(4-fluorophenyl)-3-[1-[5-isopropyl-1-(2-pyridyl)pyrazole-4-carbonyl]-4-piperidyl]propionic acid ethyl ester Formula: C28H33FN4O3 MolecularWeight: 492.585023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=N3)C(C)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)CC(C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=N3)C(C)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H33FN4O3/c1-4-36-26(34)17-23(20-8-10-22(29)11-9-20)21-12-15-32(16-13-21)28(35)24-18-31-33(27(24)19(2)3)25-7-5-6-14-30-25/h5-11,14,18-19,21,23H,4,12-13,15-17H2,1-3H3