[4-(5-methylpyrimidin-2-yl)phenyl] octanoate

Systemtic Name: [4-(5-methylpyrimidin-2-yl)phenyl] octanoate Openeye Name: [4-(5-methylpyrimidin-2-yl)phenyl] octanoate CAS Name: octanoic acid [4-(5-methyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-methylpyrimidin-2-yl)phenyl] octanoate Traditional Name: caprylic acid [4-(5-methylpyrimidin-2-yl)phenyl] ester Formula: C19H24N2O2 MolecularWeight: 312.40606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O2/c1-3-4-5-6-7-8-18(22)23-17-11-9-16(10-12-17)19-20-13-15(2)14-21-19/h9-14H,3-8H2,1-2H3