2-(4-octylphenyl)-5-undecoxy-pyrimidine

Systemtic Name: 2-(4-octylphenyl)-5-undecoxy-pyrimidine Openeye Name: 2-(4-octylphenyl)-5-undecoxy-pyrimidine CAS Name: 2-(4-octylphenyl)-5-undecoxypyrimidine IUPAC Name: 2-(4-octylphenyl)-5-undecoxypyrimidine Traditional Name: 2-(4-octylphenyl)-5-undecoxy-pyrimidine Formula: C29H46N2O MolecularWeight: 438.68834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCC

InChI

InChI=1S/C29H46N2O/c1-3-5-7-9-11-12-13-15-17-23-32-28-24-30-29(31-25-28)27-21-19-26(20-22-27)18-16-14-10-8-6-4-2/h19-22,24-25H,3-18,23H2,1-2H3