2-[4-[4-[(3-butyloxiran-2-yl)methoxy]phenyl]phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-[4-[(3-butyloxiran-2-yl)methoxy]phenyl]phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-[4-[(3-butyloxiran-2-yl)methoxy]phenyl]phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-[4-[(3-butyl-2-oxiranyl)methoxy]phenyl]phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-[4-[(3-butyloxiran-2-yl)methoxy]phenyl]phenyl]-5-octylpyrimidine Traditional Name: 2-[4-[4-[(3-butyloxiran-2-yl)methoxy]phenyl]phenyl]-5-octyl-pyrimidine Formula: C31H40N2O2 MolecularWeight: 472.6615

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC4C(O4)CCCC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC4C(O4)CCCC

InChI

InChI=1S/C31H40N2O2/c1-3-5-7-8-9-10-11-24-21-32-31(33-22-24)27-15-13-25(14-16-27)26-17-19-28(20-18-26)34-23-30-29(35-30)12-6-4-2/h13-22,29-30H,3-12,23H2,1-2H3