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2-(1,3-dioxoisoindolin-2-yl)ethanesulfonate

PropertiesImage
MNX_IDMNXM32296 Image of MNXM32296
referencemetacycM:CPD0-1957
formulaC10H8NO5S
global charge-1
mol weight254.243
InChIKeyGSLVEXPADWBUAC-UHFFFAOYSA-M
InChIInChI=1S/C10H9NO5S/c12-9-7-3-1-2-4-8(7)10(13)11(9)5-6-17(14,15)16/h1-4H,5-6H2,(H,14,15,16)/p-1
SMILESO=C1C2=CC=CC=C2C(=O)N1CCS(=O)(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H9NO5S/c12-9-7-3-1-2-4-8(7)10(13)11(9)5-6-17(14,15)16/h1-4H,5-6H2,(H,14,15,16) Image of MNXM32296
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:8]2[C:7](=[CH:3]1)[C:9](=[O:12])[N:11]([CH2:5][CH2:6][S:17]([OH:14])(=[O:15])=[O:16])[C:10]2=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD0-1957
metacycM:CPD0-1957
GSLVEXPADWBUAC-UHFFFAOYSA-M
2-(1,3-dioxoisoindolin-2-yl)ethanesulfonate
1,3-dioxo-2-isoindolineethanesulfonate
1,3-dioxo-2-isoindolineethanesulfonic acid

seed.compound:cpd26363
seedM:cpd26363
GSLVEXPADWBUAC-UHFFFAOYSA-M
1,3-dioxo-2-isoindolineethanesulfonate
1,3-dioxo-2-isoindolineethanesulfonic acid

seedM:M_cpd26363
secondary/obsolete/fantasy identifier