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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > sulfone > sulcotrione
organooxygen compound > carbonyl compound > ketone > aromatic ketone > sulcotrione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > sulcotrione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > sulcotrione
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexanones > sulcotrione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexanones > sulcotrione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexanones > sulcotrione

Preferred term

sulcotrione  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C14H13ClO5S

has_role

inchi

  • InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3

inchikey

  • PQTBTIFWAXVEPB-UHFFFAOYSA-N

mass

  • 328.76800

monoisotopicmass

  • 328.01722

smiles

  • CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1

subset

  • 3_STAR

synonym EXACT

  • 2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:83465

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