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[6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-hexoxybenzoate

[6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-hexoxybenzoate

Systemtic Name:[6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-hexoxybenzoate
Openeye Name:[6-[2-(4-cyanophenyl)ethyl]-3-pyridyl] 4-hexoxybenzoate
CAS Name:4-hexoxybenzoic acid [6-[2-(4-cyanophenyl)ethyl]-3-pyridinyl] ester
IUPAC Name:[6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-hexoxybenzoate
Traditional Name:4-hexoxybenzoic acid [6-[2-(4-cyanophenyl)ethyl]-3-pyridyl] ester
Formula: C27H28N2O3
MolecularWeight: 428.52282
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)C#N


Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)C#N


InChI

InChI=1S/C27H28N2O3/c1-2-3-4-5-18-31-25-15-11-23(12-16-25)27(30)32-26-17-14-24(29-20-26)13-10-21-6-8-22(19-28)9-7-21/h6-9,11-12,14-17,20H,2-5,10,13,18H2,1H3


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