bis(pyridin-4-ylmethyl) 4-(trifluoromethyl)pyridine-2,6-dicarboxylate

Systemtic Name: bis(pyridin-4-ylmethyl) 4-(trifluoromethyl)pyridine-2,6-dicarboxylate Openeye Name: bis(4-pyridylmethyl) 4-(trifluoromethyl)pyridine-2,6-dicarboxylate CAS Name: 4-(trifluoromethyl)pyridine-2,6-dicarboxylic acid bis(pyridin-4-ylmethyl) ester IUPAC Name: bis(pyridin-4-ylmethyl) 4-(trifluoromethyl)pyridine-2,6-dicarboxylate Traditional Name: 4-(trifluoromethyl)pyridine-2,6-dicarboxylic acid bis(4-pyridylmethyl) ester Formula: C20H14F3N3O4 MolecularWeight: 417.33807

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1COC(=O)C2=CC(=CC(=N2)C(=O)OCC3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

C1=CN=CC=C1COC(=O)C2=CC(=CC(=N2)C(=O)OCC3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C20H14F3N3O4/c21-20(22,23)15-9-16(18(27)29-11-13-1-5-24-6-2-13)26-17(10-15)19(28)30-12-14-3-7-25-8-4-14/h1-10H,11-12H2