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5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine

5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine

Systemtic Name:5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine
Openeye Name:5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine
CAS Name:5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine
IUPAC Name:5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine
Traditional Name:5-[(E)-non-1-enyl]-2-[2-(4-octoxyphenyl)ethynyl]pyrimidine
Formula: C29H40N2O
MolecularWeight: 432.6407
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=N2)C=CCCCCCCC


Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=N2)/C=C/CCCCCCC


InChI

InChI=1S/C29H40N2O/c1-3-5-7-9-11-12-14-16-27-24-30-29(31-25-27)22-19-26-17-20-28(21-18-26)32-23-15-13-10-8-6-4-2/h14,16-18,20-21,24-25H,3-13,15,23H2,1-2H3/b16-14+


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