(phenylmethyl) 4-pyrimidin-5-ylbenzoate

Systemtic Name: (phenylmethyl) 4-pyrimidin-5-ylbenzoate Openeye Name: benzyl 4-pyrimidin-5-ylbenzoate CAS Name: 4-(5-pyrimidinyl)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-pyrimidin-5-ylbenzoate Traditional Name: 4-(5-pyrimidyl)benzoic acid benzyl ester Formula: C18H14N2O2 MolecularWeight: 290.31596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C3=CN=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C3=CN=CN=C3

InChI

InChI=1S/C18H14N2O2/c21-18(22-12-14-4-2-1-3-5-14)16-8-6-15(7-9-16)17-10-19-13-20-11-17/h1-11,13H,12H2