CHEBI:194700 - 6-Chloro-1-benzothiopyran-4-one 1,1-dioxide

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ChEBI Name 6-Chloro-1-benzothiopyran-4-one 1,1-dioxide
ChEBI ID CHEBI:194700
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C9H7ClO3S
Net Charge 0
Average Mass 230.660
Monoisotopic Mass 229.98044
InChI InChI=1S/C9H7ClO3S/c10-6-1-2-9-7(5-6)8(11)3-4-14(9,12)13/h1-2,5H,3-4H2
InChIKey ZFZPMYLZPMMUQA-UHFFFAOYSA-N
SMILES ClC1=CC2=C(S(=O)(=O)CCC2=O)C=C1
ChEBI Ontology
Outgoing 6-Chloro-1-benzothiopyran-4-one 1,1-dioxide (CHEBI:194700) is a thiochromane (CHEBI:50747)
IUPAC Name
6-chloro-1,1-dioxo-2,3-dihydrothiochromen-4-one
Manual Xrefs Databases
2020731 ChemSpider
D73315 KEGG DRUG
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