diethyl 4-(5-bromanyl-2-methoxy-phenyl)-1-[(4-fluorophenyl)methyl]-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(5-bromanyl-2-methoxy-phenyl)-1-[(4-fluorophenyl)methyl]-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(5-bromo-2-methoxy-phenyl)-1-[(4-fluorophenyl)methyl]-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(5-bromo-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(5-bromo-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-1-(4-fluorobenzyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C25H25BrFNO5 MolecularWeight: 518.372103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OC)C(=O)OCC)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OC)C(=O)OCC)CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H25BrFNO5/c1-4-32-24(29)20-14-28(13-16-6-9-18(27)10-7-16)15-21(25(30)33-5-2)23(20)19-12-17(26)8-11-22(19)31-3/h6-12,14-15,23H,4-5,13H2,1-3H3