1-[4-(5-dodecylpyrimidin-2-yl)phenoxy]heptan-2-ol

Systemtic Name: 1-[4-(5-dodecylpyrimidin-2-yl)phenoxy]heptan-2-ol Openeye Name: 1-[4-(5-dodecylpyrimidin-2-yl)phenoxy]heptan-2-ol CAS Name: 1-[4-(5-dodecyl-2-pyrimidinyl)phenoxy]-2-heptanol IUPAC Name: 1-[4-(5-dodecylpyrimidin-2-yl)phenoxy]heptan-2-ol Traditional Name: 1-[4-(5-laurylpyrimidin-2-yl)phenoxy]heptan-2-ol Formula: C29H46N2O2 MolecularWeight: 454.68774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CCCCC)O

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(CCCCC)O

InChI

InChI=1S/C29H46N2O2/c1-3-5-7-8-9-10-11-12-13-15-16-25-22-30-29(31-23-25)26-18-20-28(21-19-26)33-24-27(32)17-14-6-4-2/h18-23,27,32H,3-17,24H2,1-2H3