diethyl 4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-[(3,4-dimethoxyphenyl)methyl]-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-veratryl-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C28H32BrNO8 MolecularWeight: 590.45958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OCC)CC3=CC(=C(C=C3)OC)OC)C(=O)OCC)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OCC)CC3=CC(=C(C=C3)OC)OC)C(=O)OCC)Br)O

InChI

InChI=1S/C28H32BrNO8/c1-6-36-24-13-18(12-21(29)26(24)31)25-19(27(32)37-7-2)15-30(16-20(25)28(33)38-8-3)14-17-9-10-22(34-4)23(11-17)35-5/h9-13,15-16,25,31H,6-8,14H2,1-5H3