[2-(5-octoxypyrimidin-2-yl)phenyl] decanoate

Systemtic Name: [2-(5-octoxypyrimidin-2-yl)phenyl] decanoate Openeye Name: [2-(5-octoxypyrimidin-2-yl)phenyl] decanoate CAS Name: decanoic acid [2-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(5-octoxypyrimidin-2-yl)phenyl] decanoate Traditional Name: capric acid [2-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C28H42N2O3 MolecularWeight: 454.64468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC=CC=C1C2=NC=C(C=N2)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC=CC=C1C2=NC=C(C=N2)OCCCCCCCC

InChI

InChI=1S/C28H42N2O3/c1-3-5-7-9-11-12-14-20-27(31)33-26-19-16-15-18-25(26)28-29-22-24(23-30-28)32-21-17-13-10-8-6-4-2/h15-16,18-19,22-23H,3-14,17,20-21H2,1-2H3