(4-ethoxycarbonylphenyl) 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: (4-ethoxycarbonylphenyl) 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: (4-ethoxycarbonylphenyl) 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid (4-carbethoxyphenyl) ester Formula: C20H16F3N3O4 MolecularWeight: 419.35395

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=C(N(N=C2)C3=NC=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=C(N(N=C2)C3=NC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C20H16F3N3O4/c1-3-29-18(27)13-4-7-15(8-5-13)30-19(28)16-11-25-26(12(16)2)17-9-6-14(10-24-17)20(21,22)23/h4-11H,3H2,1-2H3