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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > pyrazolynate
... > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > diazole > pyrazoles > pyrazolynate
... > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > pyrazolynate
... > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > diazole > pyrazoles > pyrazolynate
organochlorine compound > chlorobenzenes > dichlorobenzene > pyrazolynate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > arenesulfonate ester > tosylate ester > pyrazolynate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > arenesulfonate ester > tosylate ester > pyrazolynate
... > organooxygen compound > ester > organosulfonic ester > arenesulfonate ester > tosylate ester > pyrazolynate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > organosulfonic ester > arenesulfonate ester > tosylate ester > pyrazolynate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > organosulfonic ester > arenesulfonate ester > tosylate ester > pyrazolynate
organooxygen compound > carbonyl compound > ketone > aromatic ketone > pyrazolynate

Preferred term

pyrazolynate  

Type

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

Broader concept

charge

  • 0

formula

  • C19H16Cl2N2O4S

has_role

inchi

  • InChI=1S/C19H16Cl2N2O4S/c1-11-4-7-14(8-5-11)28(25,26)27-19-17(12(2)22-23(19)3)18(24)15-9-6-13(20)10-16(15)21/h4-10H,1-3H3

inchikey

  • ASRAWSBMDXVNLX-UHFFFAOYSA-N

mass

  • 439.314

monoisotopicmass

  • 438.02078

smiles

  • C1(S(OC=2N(N=C(C2C(C3=CC=C(C=C3Cl)Cl)=O)C)C)(=O)=O)=CC=C(C=C1)C

subset

  • 3_STAR

synonym EXACT

  • 4-(2,4-dichlorobenzoyl)-1,3-dimethyl-1H-pyrazol-5-yl 4-methylbenzenesulfonate

synonym RELATED

  • 4-(2,4-Dichlorobenzoyl)-1,3-dimethyl-5-pyrazolyl p-toluenesulfonate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:8657

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