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2-Hydroxy-3-chloro-6-oxo-6-phenylhexa-2,4-dienoate

PropertiesImage
MNX_IDMNXM165922 Image of MNXM165922
referencesabiorkM:28120
formulaC12H9ClO4
global charge0
mol weight252.653
InChIKeyIBJDCVXDXGFGIO-FKTQTOOFSA-N
InChIInChI=1S/C12H9ClO4/c13-9(11(15)12(16)17)6-7-10(14)8-4-2-1-3-5-8/h1-7,15H,(H,16,17)/b7-6+,11-9-
SMILESO=C(/C=C/C(Cl)=C(/O)C(=O)O)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C12H9ClO4/c13-9(11(15)12(16)17)6-7-10(14)8-4-2-1-3-5-8/h1-7,15H,(H,16,17)/b7-6+,11-9- Image of MNXM165922
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:8]([C:10](/[CH:7]=[CH:6]/[C:9](=[C:11](\[C:12](=[O:16])[OH:17])[OH:15])[Cl:13])=[O:14])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:28120
sabiorkM:28120
IBJDCVXDXGFGIO-FKTQTOOFSA-N
2-Hydroxy-3-chloro-6-oxo-6-phenylhexa-2,4-dienoate