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VWO

Summary
Name:6-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid
Synonyms:7-amino-1-naphthol-3-sulfonic acid
Formula:C10 H9 N O4 S
Formal charge:0
Formula weight:239.248 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15)
InChIKeyInChI1.06HBZVNWNSRNTWPS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1ccc2cc(cc(O)c2c1)[S](O)(=O)=O
SMILESCACTVS3.385Nc1ccc2cc(cc(O)c2c1)[S](O)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(cc2c1cc(cc2O)S(=O)(=O)O)N
SMILESOpenEye OEToolkits2.0.7c1cc(cc2c1cc(cc2O)S(=O)(=O)O)N

226262

PDB entries from 2024-10-16

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