5-octoxy-2-(4-tridecylphenyl)pyrimidine

Systemtic Name: 5-octoxy-2-(4-tridecylphenyl)pyrimidine Openeye Name: 5-octoxy-2-(4-tridecylphenyl)pyrimidine CAS Name: 5-octoxy-2-(4-tridecylphenyl)pyrimidine IUPAC Name: 5-octoxy-2-(4-tridecylphenyl)pyrimidine Traditional Name: 5-octoxy-2-(4-tridecylphenyl)pyrimidine Formula: C31H50N2O MolecularWeight: 466.7415

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCC

InChI

InChI=1S/C31H50N2O/c1-3-5-7-9-11-12-13-14-15-16-18-20-28-21-23-29(24-22-28)31-32-26-30(27-33-31)34-25-19-17-10-8-6-4-2/h21-24,26-27H,3-20,25H2,1-2H3