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F0M

Summary
Name:2-methoxy-4-nitrophenol
Synonyms:4-Nitroguaiacol
Formula:C7 H7 N O4
Formal charge:0
Formula weight:169.135 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs14.522-methoxy-4-nitrophenol
OpenEye OEToolkits3.1.0.02-methoxy-4-nitro-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52Oc1ccc(cc1OC)[N+]([O-])=O
InChIInChI1.06InChI=1S/C7H7NO4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3
InChIKeyInChI1.06IZLVFLOBTPURLP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(ccc1O)[N+]([O-])=O
SMILESCACTVS3.385COc1cc(ccc1O)[N+]([O-])=O
SMILES_CANONICALOpenEye OEToolkits3.1.0.0COc1cc(ccc1O)[N+](=O)[O-]
SMILESOpenEye OEToolkits3.1.0.0COc1cc(ccc1O)[N+](=O)[O-]

253091

PDB entries from 2026-05-06

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