dimethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-phenyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H20BrNO6 MolecularWeight: 474.3013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3=CC=CC=C3)C(=O)OC)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3=CC=CC=C3)C(=O)OC)Br)O

InChI

InChI=1S/C22H20BrNO6/c1-28-18-10-13(9-17(23)20(18)25)19-15(21(26)29-2)11-24(12-16(19)22(27)30-3)14-7-5-4-6-8-14/h4-12,19,25H,1-3H3