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SQ4

Summary
Name:1-(4-aminophenyl)pyrrole-2,5-dione
Formula:C10 H8 N2 O2
Formal charge:0
Formula weight:188.183 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.61-(4-aminophenyl)pyrrole-2,5-dione

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H8N2O2/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(12)14/h1-6H,11H2
InChIKeyInChI1.03XOPCHXSYQHXLHJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1ccc(cc1)N2C(=O)C=CC2=O
SMILESCACTVS3.385Nc1ccc(cc1)N2C(=O)C=CC2=O
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(ccc1N)N2C(=O)C=CC2=O
SMILESOpenEye OEToolkits2.0.6c1cc(ccc1N)N2C(=O)C=CC2=O

219140

PDB entries from 2024-05-01

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