quinolin-8-ylmethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: quinolin-8-ylmethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: 8-quinolylmethyl 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid 8-quinolylmethyl ester Formula: C21H15F3N4O2 MolecularWeight: 412.36461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)OCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)OCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H15F3N4O2/c1-13-17(11-27-28(13)18-8-7-16(10-26-18)21(22,23)24)20(29)30-12-15-5-2-4-14-6-3-9-25-19(14)15/h2-11H,12H2,1H3