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

Systemtic Name: 2-(4-octylphenyl)-5-pentadecoxy-pyrimidine Openeye Name: 2-(4-octylphenyl)-5-pentadecoxy-pyrimidine CAS Name: 2-(4-octylphenyl)-5-pentadecoxypyrimidine IUPAC Name: 2-(4-octylphenyl)-5-pentadecoxypyrimidine Traditional Name: 2-(4-octylphenyl)-5-pentadecoxy-pyrimidine Formula: C33H54N2O MolecularWeight: 494.79466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCC

InChI

InChI=1S/C33H54N2O/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-27-36-32-28-34-33(35-29-32)31-25-23-30(24-26-31)22-20-18-10-8-6-4-2/h23-26,28-29H,3-22,27H2,1-2H3