dimethyl 2-pyridin-2-yl-5,6-bis[[3-(trifluoromethyl)phenyl]amino]pyridine-3,4-dicarboxylate

Systemtic Name: dimethyl 2-pyridin-2-yl-5,6-bis[[3-(trifluoromethyl)phenyl]amino]pyridine-3,4-dicarboxylate Openeye Name: dimethyl 2-(2-pyridyl)-5,6-bis[3-(trifluoromethyl)anilino]pyridine-3,4-dicarboxylate CAS Name: 2-(2-pyridinyl)-5,6-bis[3-(trifluoromethyl)anilino]pyridine-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-pyridin-2-yl-5,6-bis[3-(trifluoromethyl)anilino]pyridine-3,4-dicarboxylate Traditional Name: 2-(2-pyridyl)-5,6-bis[3-(trifluoromethyl)anilino]pyridine-3,4-dicarboxylic acid dimethyl ester Formula: C28H20F6N4O4 MolecularWeight: 590.473219

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NC(=C1NC2=CC=CC(=C2)C(F)(F)F)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=N4)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C(=NC(=C1NC2=CC=CC(=C2)C(F)(F)F)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=N4)C(=O)OC

InChI

InChI=1S/C28H20F6N4O4/c1-41-25(39)20-21(26(40)42-2)23(36-17-9-5-7-15(13-17)27(29,30)31)24(38-22(20)19-11-3-4-12-35-19)37-18-10-6-8-16(14-18)28(32,33)34/h3-14,36H,1-2H3,(H,37,38)