2-[4-[(4-octylphenyl)methoxy]phenyl]-5-propyl-pyrimidine

Systemtic Name: 2-[4-[(4-octylphenyl)methoxy]phenyl]-5-propyl-pyrimidine Openeye Name: 2-[4-[(4-octylphenyl)methoxy]phenyl]-5-propyl-pyrimidine CAS Name: 2-[4-[(4-octylphenyl)methoxy]phenyl]-5-propylpyrimidine IUPAC Name: 2-[4-[(4-octylphenyl)methoxy]phenyl]-5-propylpyrimidine Traditional Name: 2-[4-(4-octylbenzyl)oxyphenyl]-5-propyl-pyrimidine Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)CCC

InChI

InChI=1S/C28H36N2O/c1-3-5-6-7-8-9-11-23-12-14-24(15-13-23)22-31-27-18-16-26(17-19-27)28-29-20-25(10-4-2)21-30-28/h12-21H,3-11,22H2,1-2H3