2-[4-(4-hexylphenyl)phenyl]-5-octan-2-yloxy-pyrimidine

Systemtic Name: 2-[4-(4-hexylphenyl)phenyl]-5-octan-2-yloxy-pyrimidine Openeye Name: 2-[4-(4-hexylphenyl)phenyl]-5-(1-methylheptoxy)pyrimidine CAS Name: 2-[4-(4-hexylphenyl)phenyl]-5-octan-2-yloxypyrimidine IUPAC Name: 2-[4-(4-hexylphenyl)phenyl]-5-octan-2-yloxypyrimidine Traditional Name: 2-[4-(4-hexylphenyl)phenyl]-5-(1-methylheptoxy)pyrimidine Formula: C30H40N2O MolecularWeight: 444.6514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(C)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(C)CCCCCC

InChI

InChI=1S/C30H40N2O/c1-4-6-8-10-12-24(3)33-29-22-31-30(32-23-29)28-20-18-27(19-21-28)26-16-14-25(15-17-26)13-11-9-7-5-2/h14-24H,4-13H2,1-3H3