Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1N(C(=O)C2=C(Cl)C=CC=C2Cl)C(=O)C2=C1C=CC(=C2)[N+]([O-])=O
InChIKey
InChIKey=LSDMMFWEGBTARO-UHFFFAOYSA-N
Formula
C21H13Cl2N3O6S
Mass
506.31
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoyl derivatives
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Level 5
Benzoylpyrazoles
- Level 6 N-benzoylpyrazoles
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Level 5
Benzoylpyrazoles
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Subclass
Benzoyl derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Benzoylpyrazoles
Direct Parent
N-benzoylpyrazoles
Alternative Parents
Tosyl compounds 2-halobenzoic acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Indazoles Dichlorobenzenes Nitroaromatic compounds Pyrazolones Aryl chlorides Vinylogous halides Sulfonyls Pyrazoles Organosulfonic acids and derivatives Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organooxygen compounds Organic salts Organochlorides Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzoylpyrazole - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Tosyl compound - Benzenesulfonamide - Indazole - Benzopyrazole - Benzoic acid or derivatives - Benzenesulfonyl group - 1,3-dichlorobenzene - Nitroaromatic compound - Chlorobenzene - Halobenzene - Toluene - Pyrazolinone - Aryl halide - Aryl chloride - Organosulfonic acid or derivatives - Vinylogous halide - Organic sulfonic acid or derivatives - Pyrazole - Sulfonyl - Heteroaromatic compound - Azole - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzoylpyrazoles. These are aromatic heterocyclic compounds containing a pyrazole ring that is N-substituted at the 1-position by a benzoyl group.
External Descriptors
Not available