[4-(5-octylpyrimidin-2-yl)phenyl] decanoate

Systemtic Name: [4-(5-octylpyrimidin-2-yl)phenyl] decanoate Openeye Name: [4-(5-octylpyrimidin-2-yl)phenyl] decanoate CAS Name: decanoic acid [4-(5-octyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octylpyrimidin-2-yl)phenyl] decanoate Traditional Name: capric acid [4-(5-octylpyrimidin-2-yl)phenyl] ester Formula: C28H42N2O2 MolecularWeight: 438.64528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCCCC

InChI

InChI=1S/C28H42N2O2/c1-3-5-7-9-11-13-15-17-27(31)32-26-20-18-25(19-21-26)28-29-22-24(23-30-28)16-14-12-10-8-6-4-2/h18-23H,3-17H2,1-2H3