5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxy-pyrimidine

Systemtic Name: 5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxy-pyrimidine Openeye Name: 5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxy-pyrimidine CAS Name: 5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxypyrimidine IUPAC Name: 5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxypyrimidine Traditional Name: 5-[4-(3,7-dimethyloct-6-enoxy)phenyl]-2-octoxy-pyrimidine Formula: C28H42N2O2 MolecularWeight: 438.64528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)OCCC(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)OCCC(C)CCC=C(C)C

InChI

InChI=1S/C28H42N2O2/c1-5-6-7-8-9-10-19-32-28-29-21-26(22-30-28)25-14-16-27(17-15-25)31-20-18-24(4)13-11-12-23(2)3/h12,14-17,21-22,24H,5-11,13,18-20H2,1-4H3