1-[4-[2-(4-nonylphenyl)pyrimidin-4-yl]phenoxy]propan-2-ol

Systemtic Name: 1-[4-[2-(4-nonylphenyl)pyrimidin-4-yl]phenoxy]propan-2-ol Openeye Name: 1-[4-[2-(4-nonylphenyl)pyrimidin-4-yl]phenoxy]propan-2-ol CAS Name: 1-[4-[2-(4-nonylphenyl)-4-pyrimidinyl]phenoxy]-2-propanol IUPAC Name: 1-[4-[2-(4-nonylphenyl)pyrimidin-4-yl]phenoxy]propan-2-ol Traditional Name: 1-[4-[2-(4-nonylphenyl)pyrimidin-4-yl]phenoxy]propan-2-ol Formula: C28H36N2O2 MolecularWeight: 432.59764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NC=CC(=N2)C3=CC=C(C=C3)OCC(C)O

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NC=CC(=N2)C3=CC=C(C=C3)OCC(C)O

InChI

InChI=1S/C28H36N2O2/c1-3-4-5-6-7-8-9-10-23-11-13-25(14-12-23)28-29-20-19-27(30-28)24-15-17-26(18-16-24)32-21-22(2)31/h11-20,22,31H,3-10,21H2,1-2H3