methyl 2-[[2-(trifluoromethyl)pyridin-4-yl]amino]pyridine-3-carboxylate

Systemtic Name: methyl 2-[[2-(trifluoromethyl)pyridin-4-yl]amino]pyridine-3-carboxylate Openeye Name: methyl 2-[[2-(trifluoromethyl)-4-pyridyl]amino]pyridine-3-carboxylate CAS Name: 2-[[2-(trifluoromethyl)-4-pyridinyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(trifluoromethyl)pyridin-4-yl]amino]pyridine-3-carboxylate Traditional Name: 2-[[2-(trifluoromethyl)-4-pyridyl]amino]nicotinic acid methyl ester Formula: C13H10F3N3O2 MolecularWeight: 297.23261

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=CC=C1)NC2=CC(=NC=C2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(N=CC=C1)NC2=CC(=NC=C2)C(F)(F)F

InChI

InChI=1S/C13H10F3N3O2/c1-21-12(20)9-3-2-5-18-11(9)19-8-4-6-17-10(7-8)13(14,15)16/h2-7H,1H3,(H,17,18,19)