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RXO

Summary
Name:4-arsanyl-2-nitrophenol
Formula:C6 H6 As N O3
Formal charge:0
Formula weight:215.038 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-arsanyl-2-nitrophenol
OpenEye OEToolkits1.7.64-arsanyl-2-nitro-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=[N+]([O-])c1cc(ccc1O)[AsH2]
InChIInChI1.03InChI=1S/C6H6AsNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H,7H2
InChIKeyInChI1.03POYWCBSQXBGKKH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc([AsH2])cc1[N+]([O-])=O
SMILESCACTVS3.385Oc1ccc([AsH2])cc1[N+]([O-])=O
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(c(cc1[AsH2])[N+](=O)[O-])O
SMILESOpenEye OEToolkits1.7.6c1cc(c(cc1[AsH2])[N+](=O)[O-])O

223532

PDB entries from 2024-08-07

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