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diethyl 2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioate

diethyl 2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioate

Systemtic Name:diethyl 2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioate
Openeye Name:diethyl 2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioate
CAS Name:2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioic acid diethyl ester
IUPAC Name:diethyl 2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]propanedioate
Traditional Name:2-[4-[2-(4-cyanophenyl)phenoxy]hexyl]malonic acid diethyl ester
Formula: C26H31NO5
MolecularWeight: 437.52804
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC(C(=O)OCC)C(=O)OCC)OC1=CC=CC=C1C2=CC=C(C=C2)C#N


Isomeric SMILES

CCC(CCCC(C(=O)OCC)C(=O)OCC)OC1=CC=CC=C1C2=CC=C(C=C2)C#N


InChI

InChI=1S/C26H31NO5/c1-4-21(10-9-12-23(25(28)30-5-2)26(29)31-6-3)32-24-13-8-7-11-22(24)20-16-14-19(18-27)15-17-20/h7-8,11,13-17,21,23H,4-6,9-10,12H2,1-3H3


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