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A1CFH

Summary
Name:7-benzamido-4-hydroxynaphthalene-2-sulfonic acid
Formula:C17 H13 N O5 S
Formal charge:0
Formula weight:343.354 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.527-benzamido-4-hydroxynaphthalene-2-sulfonic acid
OpenEye OEToolkits3.1.0.07-benzamido-4-oxidanyl-naphthalene-2-sulfonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52O=S(=O)(O)c1cc(O)c2ccc(cc2c1)NC(=O)c1ccccc1
InChIInChI1.06InChI=1S/C17H13NO5S/c19-16-10-14(24(21,22)23)9-12-8-13(6-7-15(12)16)18-17(20)11-4-2-1-3-5-11/h1-10,19H,(H,18,20)(H,21,22,23)
InChIKeyInChI1.06ZLHGMJOGMLVDFS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cc(cc2cc(NC(=O)c3ccccc3)ccc12)[S](O)(=O)=O
SMILESCACTVS3.385Oc1cc(cc2cc(NC(=O)c3ccccc3)ccc12)[S](O)(=O)=O
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc(cc1)C(=O)Nc2ccc3c(c2)cc(cc3O)S(=O)(=O)O
SMILESOpenEye OEToolkits3.1.0.0c1ccc(cc1)C(=O)Nc2ccc3c(c2)cc(cc3O)S(=O)(=O)O

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PDB entries from 2026-02-04

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