diethyl 4-[5-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enoxy]phenyl]-1-(4-ethoxycarbonylphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-[5-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enoxy]phenyl]-1-(4-ethoxycarbonylphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-[5-bromo-2-[(E)-3-ethoxy-3-oxo-prop-1-enoxy]phenyl]-1-(4-ethoxycarbonylphenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-[5-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enoxy]phenyl]-1-(4-ethoxycarbonylphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[5-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enoxy]phenyl]-1-(4-ethoxycarbonylphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-[5-bromo-2-[(E)-3-ethoxy-3-keto-prop-1-enoxy]phenyl]-1-(4-carbethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C31H32BrNO9 MolecularWeight: 642.49108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C/OC1=C(C=C(C=C1)Br)C2C(=CN(C=C2C(=O)OCC)C3=CC=C(C=C3)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C31H32BrNO9/c1-5-38-27(34)15-16-42-26-14-11-21(32)17-23(26)28-24(30(36)40-7-3)18-33(19-25(28)31(37)41-8-4)22-12-9-20(10-13-22)29(35)39-6-2/h9-19,28H,5-8H2,1-4H3/b16-15+