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The molecular formula is C16H13NO3.
The molecular weight is 267.28 g/mol.
The IUPAC name is 2-(2-methoxyphenyl)-4H-isoquinoline-1,3-dione.
The InChI is InChI=1S/C16H13NO3/c1-20-14-9-5-4-8-13(14)17-15(18)10-11-6-2-3-7-12(11)16(17)19/h2-9H,10H2,1H3.
The InChIKey is XGAWVNADRTWTGY-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC=CC=C1N2C(=O)CC3=CC=CC=C3C2=O.
The CAS number is 106128-44-3.
The ChEMBL ID is CHEMBL88811.
Yes, it is a covalently-bonded unit with a count of 1.
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4-[(4-Formyl-2-methoxyphenoxy)methyl]benzonitrile
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