2-[[2-oxidanylidene-3-(phenylcarbonyl)-1H-pyridin-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-oxidanylidene-3-(phenylcarbonyl)-1H-pyridin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[(3-benzoyl-2-oxo-1H-pyridin-4-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(3-benzoyl-2-oxo-1H-pyridin-4-yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(3-benzoyl-2-oxo-1H-pyridin-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(3-benzoyl-2-keto-1H-pyridin-4-yl)methyl]isoindoline-1,3-quinone Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CNC2=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CNC2=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H14N2O4/c24-18(13-6-2-1-3-7-13)17-14(10-11-22-19(17)25)12-23-20(26)15-8-4-5-9-16(15)21(23)27/h1-11H,12H2,(H,22,25)