diethyl 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(3-bromo-4-ethoxy-5-methoxy-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-4-ethoxy-5-methoxy-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C21H26BrNO6 MolecularWeight: 468.33824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C2C(=CN(C=C2C(=O)OCC)C)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C2C(=CN(C=C2C(=O)OCC)C)C(=O)OCC)OC

InChI

InChI=1S/C21H26BrNO6/c1-6-27-19-16(22)9-13(10-17(19)26-5)18-14(20(24)28-7-2)11-23(4)12-15(18)21(25)29-8-3/h9-12,18H,6-8H2,1-5H3