(4-pyrimidin-2-ylphenyl) undecanoate

Systemtic Name: (4-pyrimidin-2-ylphenyl) undecanoate Openeye Name: (4-pyrimidin-2-ylphenyl) undecanoate CAS Name: undecanoic acid [4-(2-pyrimidinyl)phenyl] ester IUPAC Name: (4-pyrimidin-2-ylphenyl) undecanoate Traditional Name: undecanoic acid [4-(2-pyrimidyl)phenyl] ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O2/c1-2-3-4-5-6-7-8-9-11-20(24)25-19-14-12-18(13-15-19)21-22-16-10-17-23-21/h10,12-17H,2-9,11H2,1H3