ethyl 3-[1-(1,5-dimethylpyrazol-4-yl)carbonylpiperidin-4-yl]-3-(4-fluorophenyl)propanoate

Systemtic Name: ethyl 3-[1-(1,5-dimethylpyrazol-4-yl)carbonylpiperidin-4-yl]-3-(4-fluorophenyl)propanoate Openeye Name: ethyl 3-[1-(1,5-dimethylpyrazole-4-carbonyl)-4-piperidyl]-3-(4-fluorophenyl)propanoate CAS Name: 3-[1-[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]-4-piperidinyl]-3-(4-fluorophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(1,5-dimethylpyrazole-4-carbonyl)piperidin-4-yl]-3-(4-fluorophenyl)propanoate Traditional Name: 3-[1-(1,5-dimethylpyrazole-4-carbonyl)-4-piperidyl]-3-(4-fluorophenyl)propionic acid ethyl ester Formula: C22H28FN3O3 MolecularWeight: 401.474423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28FN3O3/c1-4-29-21(27)13-19(16-5-7-18(23)8-6-16)17-9-11-26(12-10-17)22(28)20-14-24-25(3)15(20)2/h5-8,14,17,19H,4,9-13H2,1-3H3