2-[4-(6-ethoxyheptoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(6-ethoxyheptoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(6-ethoxyheptoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(6-ethoxyheptoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(6-ethoxyheptoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(6-ethoxyheptoxy)phenyl]-5-octyl-pyrimidine Formula: C27H42N2O2 MolecularWeight: 426.63458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)OCC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)OCC

InChI

InChI=1S/C27H42N2O2/c1-4-6-7-8-9-12-15-24-21-28-27(29-22-24)25-16-18-26(19-17-25)31-20-13-10-11-14-23(3)30-5-2/h16-19,21-23H,4-15,20H2,1-3H3