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8PJ

Summary
Name:3-nitropyridin-2-ol
Formula:C5 H4 N2 O3
Formal charge:0
Formula weight:140.097 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63-nitropyridin-2-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H4N2O3/c8-5-4(7(9)10)2-1-3-6-5/h1-3H,(H,6,8)
InChIKeyInChI1.03BOAFCICMVMFLIT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ncccc1[N+]([O-])=O
SMILESCACTVS3.385Oc1ncccc1[N+]([O-])=O
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(c(nc1)O)[N+](=O)[O-]
SMILESOpenEye OEToolkits2.0.6c1cc(c(nc1)O)[N+](=O)[O-]

221051

PDB entries from 2024-06-12

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