dimethyl 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(3-chlorophenyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H17ClFNO4 MolecularWeight: 401.815383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)F)C(=O)OC)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)F)C(=O)OC)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H17ClFNO4/c1-27-20(25)17-11-24(16-5-3-4-14(22)10-16)12-18(21(26)28-2)19(17)13-6-8-15(23)9-7-13/h3-12,19H,1-2H3