(4-octylphenyl)-[4-(5-pentylpyrimidin-2-yl)phenyl]methanol

Systemtic Name: (4-octylphenyl)-[4-(5-pentylpyrimidin-2-yl)phenyl]methanol Openeye Name: (4-octylphenyl)-[4-(5-pentylpyrimidin-2-yl)phenyl]methanol CAS Name: (4-octylphenyl)-[4-(5-pentyl-2-pyrimidinyl)phenyl]methanol IUPAC Name: (4-octylphenyl)-[4-(5-pentylpyrimidin-2-yl)phenyl]methanol Traditional Name: [4-(5-amylpyrimidin-2-yl)phenyl]-(4-octylphenyl)methanol Formula: C30H40N2O MolecularWeight: 444.6514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCC)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCC)O

InChI

InChI=1S/C30H40N2O/c1-3-5-7-8-9-11-12-24-14-16-26(17-15-24)29(33)27-18-20-28(21-19-27)30-31-22-25(23-32-30)13-10-6-4-2/h14-23,29,33H,3-13H2,1-2H3