4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine

Systemtic Name: 4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine Openeye Name: 4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine CAS Name: 4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine IUPAC Name: 4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine Traditional Name: 4-(4-butoxyphenyl)-6-(4-octoxyphenyl)pyrimidine Formula: C28H36N2O2 MolecularWeight: 432.59764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=NC(=C2)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=NC(=C2)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C28H36N2O2/c1-3-5-7-8-9-10-20-32-26-17-13-24(14-18-26)28-21-27(29-22-30-28)23-11-15-25(16-12-23)31-19-6-4-2/h11-18,21-22H,3-10,19-20H2,1-2H3