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L6Y

Summary
Name:2-oxidanyl-6-(phenylcarbonyl)benzo[de]isoquinoline-1,3-dione
Formula:C19 H11 N O4
Formal charge:0
Formula weight:317.295 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.9.22-oxidanyl-6-(phenylcarbonyl)benzo[de]isoquinoline-1,3-dione

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C19H11NO4/c21-17(11-5-2-1-3-6-11)13-9-10-15-16-12(13)7-4-8-14(16)18(22)20(24)19(15)23/h1-10,24H
InChIKeyInChI1.03AFGMHSZWGJYWFH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385ON1C(=O)c2cccc3c(ccc(C1=O)c23)C(=O)c4ccccc4
SMILESCACTVS3.385ON1C(=O)c2cccc3c(ccc(C1=O)c23)C(=O)c4ccccc4
SMILES_CANONICALOpenEye OEToolkits1.9.2c1ccc(cc1)C(=O)c2ccc3c4c2cccc4C(=O)N(C3=O)O
SMILESOpenEye OEToolkits1.9.2c1ccc(cc1)C(=O)c2ccc3c4c2cccc4C(=O)N(C3=O)O

223166

PDB entries from 2024-07-31

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