2-(4-hexylphenyl)-5-[(4-octylphenyl)methoxy]pyrimidine

Systemtic Name: 2-(4-hexylphenyl)-5-[(4-octylphenyl)methoxy]pyrimidine Openeye Name: 2-(4-hexylphenyl)-5-[(4-octylphenyl)methoxy]pyrimidine CAS Name: 2-(4-hexylphenyl)-5-[(4-octylphenyl)methoxy]pyrimidine IUPAC Name: 2-(4-hexylphenyl)-5-[(4-octylphenyl)methoxy]pyrimidine Traditional Name: 2-(4-hexylphenyl)-5-(4-octylbenzyl)oxy-pyrimidine Formula: C31H42N2O MolecularWeight: 458.67798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)COC2=CN=C(N=C2)C3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)COC2=CN=C(N=C2)C3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C31H42N2O/c1-3-5-7-9-10-12-14-26-15-17-28(18-16-26)25-34-30-23-32-31(33-24-30)29-21-19-27(20-22-29)13-11-8-6-4-2/h15-24H,3-14,25H2,1-2H3