2-(4-heptoxyphenyl)-5-(4-pentylphenyl)pyrimidine

Systemtic Name: 2-(4-heptoxyphenyl)-5-(4-pentylphenyl)pyrimidine Openeye Name: 2-(4-heptoxyphenyl)-5-(4-pentylphenyl)pyrimidine CAS Name: 2-(4-heptoxyphenyl)-5-(4-pentylphenyl)pyrimidine IUPAC Name: 2-(4-heptoxyphenyl)-5-(4-pentylphenyl)pyrimidine Traditional Name: 5-(4-amylphenyl)-2-(4-heptoxyphenyl)pyrimidine Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C28H36N2O/c1-3-5-7-8-10-20-31-27-18-16-25(17-19-27)28-29-21-26(22-30-28)24-14-12-23(13-15-24)11-9-6-4-2/h12-19,21-22H,3-11,20H2,1-2H3