ethyl 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolyl]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]acetyl]nipecotic acid ethyl ester Formula: C21H25F3N4O3 MolecularWeight: 438.44341

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC2=C(N(N=C2C)C3=NC=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CC2=C(N(N=C2C)C3=NC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C21H25F3N4O3/c1-4-31-20(30)15-6-5-9-27(12-15)19(29)10-17-13(2)26-28(14(17)3)18-8-7-16(11-25-18)21(22,23)24/h7-8,11,15H,4-6,9-10,12H2,1-3H3