(phenylmethyl) 3-(2-chloranylpyrimidin-4-yl)benzoate

Systemtic Name: (phenylmethyl) 3-(2-chloranylpyrimidin-4-yl)benzoate Openeye Name: benzyl 3-(2-chloropyrimidin-4-yl)benzoate CAS Name: 3-(2-chloro-4-pyrimidinyl)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(2-chloropyrimidin-4-yl)benzoate Traditional Name: 3-(2-chloropyrimidin-4-yl)benzoic acid benzyl ester Formula: C18H13ClN2O2 MolecularWeight: 324.76102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=CC(=C2)C3=NC(=NC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=CC(=C2)C3=NC(=NC=C3)Cl

InChI

InChI=1S/C18H13ClN2O2/c19-18-20-10-9-16(21-18)14-7-4-8-15(11-14)17(22)23-12-13-5-2-1-3-6-13/h1-11H,12H2