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diethyl 2-[1-(4-cyanophenyl)-3-oxidanylidene-3-pyridin-2-yl-propyl]propanedioate

diethyl 2-[1-(4-cyanophenyl)-3-oxidanylidene-3-pyridin-2-yl-propyl]propanedioate

Systemtic Name:diethyl 2-[1-(4-cyanophenyl)-3-oxidanylidene-3-pyridin-2-yl-propyl]propanedioate
Openeye Name:diethyl 2-[1-(4-cyanophenyl)-3-oxo-3-(2-pyridyl)propyl]propanedioate
CAS Name:2-[1-(4-cyanophenyl)-3-oxo-3-(2-pyridinyl)propyl]propanedioic acid diethyl ester
IUPAC Name:diethyl 2-[1-(4-cyanophenyl)-3-oxo-3-pyridin-2-ylpropyl]propanedioate
Traditional Name:2-[1-(4-cyanophenyl)-3-keto-3-(2-pyridyl)propyl]malonic acid diethyl ester
Formula: C22H22N2O5
MolecularWeight: 394.42048
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC(=O)C1=CC=CC=N1)C2=CC=C(C=C2)C#N)C(=O)OCC


Isomeric SMILES

CCOC(=O)C(C(CC(=O)C1=CC=CC=N1)C2=CC=C(C=C2)C#N)C(=O)OCC


InChI

InChI=1S/C22H22N2O5/c1-3-28-21(26)20(22(27)29-4-2)17(16-10-8-15(14-23)9-11-16)13-19(25)18-7-5-6-12-24-18/h5-12,17,20H,3-4,13H2,1-2H3


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