dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(4-fluorophenyl)methyl]-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(4-fluorobenzyl)-4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H21FN2O8 MolecularWeight: 472.419843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C23H21FN2O8/c1-32-19-9-14(8-18(21(19)27)26(30)31)20-16(22(28)33-2)11-25(12-17(20)23(29)34-3)10-13-4-6-15(24)7-5-13/h4-9,11-12,20,27H,10H2,1-3H3