Compound Identification
SMILES
CCOC=NC1=C(Cl)C(=O)C(N=COCC)=C(Cl)C1=O
InChIKey
InChIKey=DSASAAGHRLSPQK-UHFFFAOYSA-N
Formula
C12H12Cl2N2O4
Mass
319.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinones
-
Level 8
Benzoquinones
- Level 9 P-benzoquinones
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Level 8
Benzoquinones
-
Level 7
Quinones
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinones - Benzoquinones
Direct Parent
P-benzoquinones
Alternative Parents
Vinylogous halides Alpha-chloroketones Imidoesters Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Chloroalkenes Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
P-benzoquinone - Alpha-haloketone - Alpha-chloroketone - Vinylogous halide - Imido ester - Carboximidic acid derivative - Vinyl chloride - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Haloalkene - Chloroalkene - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 4-positions, respectively.
External Descriptors
Not available