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WV6

Summary
Name:4-[4-(dimethylamino)benzene-1-sulfonyl]benzene-1,2-diol
Formula:C14 H15 N O4 S
Formal charge:0
Formula weight:293.338 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-[4-(dimethylamino)benzene-1-sulfonyl]benzene-1,2-diol
OpenEye OEToolkits2.0.74-[4-(dimethylamino)phenyl]sulfonylbenzene-1,2-diol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Oc1ccc(cc1O)S(=O)(=O)c1ccc(cc1)N(C)C
InChIInChI1.06InChI=1S/C14H15NO4S/c1-15(2)10-3-5-11(6-4-10)20(18,19)12-7-8-13(16)14(17)9-12/h3-9,16-17H,1-2H3
InChIKeyInChI1.06HZLUKLZSINXTRV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CN(C)c1ccc(cc1)[S](=O)(=O)c2ccc(O)c(O)c2
SMILESCACTVS3.385CN(C)c1ccc(cc1)[S](=O)(=O)c2ccc(O)c(O)c2
SMILES_CANONICALOpenEye OEToolkits2.0.7CN(C)c1ccc(cc1)S(=O)(=O)c2ccc(c(c2)O)O
SMILESOpenEye OEToolkits2.0.7CN(C)c1ccc(cc1)S(=O)(=O)c2ccc(c(c2)O)O

262513

PDB entries from 2026-11-04

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