diethyl 2-methyl-1-(2-pyridin-3-ylcyclopropyl)-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-methyl-1-(2-pyridin-3-ylcyclopropyl)-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 2-methyl-1-[2-(3-pyridyl)cyclopropyl]-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2-methyl-1-[2-(3-pyridinyl)cyclopropyl]-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-1-(2-pyridin-3-ylcyclopropyl)-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 2-methyl-1-[2-(3-pyridyl)cyclopropyl]-4-(trifluoromethyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C21H23F3N2O4 MolecularWeight: 424.41353

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=C(C1C(F)(F)F)C(=O)OCC)C)C2CC2C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN(C(=C(C1C(F)(F)F)C(=O)OCC)C)C2CC2C3=CN=CC=C3

InChI

InChI=1S/C21H23F3N2O4/c1-4-29-19(27)15-11-26(16-9-14(16)13-7-6-8-25-10-13)12(3)17(20(28)30-5-2)18(15)21(22,23)24/h6-8,10-11,14,16,18H,4-5,9H2,1-3H3