ClassyFire

Compound Identification

SMILES

CCN(CC)P(Cl)(N(CC)CC)(N(CC)CC)C1=C(Cl)C(=O)C(C#N)=C(C#N)C1=O

InChIKey

InChIKey=KYWXONKXCFYDGW-UHFFFAOYSA-N

Formula

C20H30Cl2N5O2P

Mass

474.37

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

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 Vinyl chlorides Nitriles Chloroalkenes Organophosphorus compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

P-benzoquinone - Alpha-haloketone - Alpha-chloroketone - Vinylogous halide - Carbonitrile - Nitrile - Vinyl chloride - Chloroalkene - Haloalkene - Vinyl halide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organophosphorus compound - Organonitrogen compound - Organochloride - Organohalogen compound - Cyanide - 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

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