[5-ethynyl-2-(phenylcarbonyloxy)pyrimidin-4-yl] benzoate

Systemtic Name: [5-ethynyl-2-(phenylcarbonyloxy)pyrimidin-4-yl] benzoate Openeye Name: (2-benzoyloxy-5-ethynyl-pyrimidin-4-yl) benzoate CAS Name: benzoic acid (2-benzoyloxy-5-ethynyl-4-pyrimidinyl) ester IUPAC Name: (2-benzoyloxy-5-ethynylpyrimidin-4-yl) benzoate Traditional Name: benzoic acid (2-benzoyloxy-5-ethynyl-pyrimidin-4-yl) ester Formula: C20H12N2O4 MolecularWeight: 344.32028

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN=C(N=C1OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C#CC1=CN=C(N=C1OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H12N2O4/c1-2-14-13-21-20(26-19(24)16-11-7-4-8-12-16)22-17(14)25-18(23)15-9-5-3-6-10-15/h1,3-13H