2-[4-(2-methyloctyl)phenyl]-5-octoxy-pyrimidine

Systemtic Name: 2-[4-(2-methyloctyl)phenyl]-5-octoxy-pyrimidine Openeye Name: 2-[4-(2-methyloctyl)phenyl]-5-octoxy-pyrimidine CAS Name: 2-[4-(2-methyloctyl)phenyl]-5-octoxypyrimidine IUPAC Name: 2-[4-(2-methyloctyl)phenyl]-5-octoxypyrimidine Traditional Name: 2-[4-(2-methyloctyl)phenyl]-5-octoxy-pyrimidine Formula: C27H42N2O MolecularWeight: 410.63518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)CCCCCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)CCCCCC

InChI

InChI=1S/C27H42N2O/c1-4-6-8-10-11-13-19-30-26-21-28-27(29-22-26)25-17-15-24(16-18-25)20-23(3)14-12-9-7-5-2/h15-18,21-23H,4-14,19-20H2,1-3H3