2-[4-(2-butoxypropoxy)phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-(2-butoxypropoxy)phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(2-butoxypropoxy)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(2-butoxypropoxy)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(2-butoxypropoxy)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(2-butoxypropoxy)phenyl]-5-octyl-pyrimidine Formula: C25H38N2O2 MolecularWeight: 398.58142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38N2O2/c1-4-6-8-9-10-11-12-22-18-26-25(27-19-22)23-13-15-24(16-14-23)29-20-21(3)28-17-7-5-2/h13-16,18-19,21H,4-12,17,20H2,1-3H3