(E)-7-[4-(5-decoxypyrimidin-2-yl)phenyl]hept-6-en-2-ol

Systemtic Name: (E)-7-[4-(5-decoxypyrimidin-2-yl)phenyl]hept-6-en-2-ol Openeye Name: (E)-7-[4-(5-decoxypyrimidin-2-yl)phenyl]hept-6-en-2-ol CAS Name: (E)-7-[4-(5-decoxy-2-pyrimidinyl)phenyl]-6-hepten-2-ol IUPAC Name: (E)-7-[4-(5-decoxypyrimidin-2-yl)phenyl]hept-6-en-2-ol Traditional Name: (E)-7-[4-(5-decoxypyrimidin-2-yl)phenyl]hept-6-en-2-ol Formula: C27H40N2O2 MolecularWeight: 424.6187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C=CCCCC(C)O

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)/C=C/CCCC(C)O

InChI

InChI=1S/C27H40N2O2/c1-3-4-5-6-7-8-9-13-20-31-26-21-28-27(29-22-26)25-18-16-24(17-19-25)15-12-10-11-14-23(2)30/h12,15-19,21-23,30H,3-11,13-14,20H2,1-2H3/b15-12+