Compound Identification
SMILES
[Na+].CCCCP([O-])(=O)CC(O)(CN)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=HMJJSAPVKNSPMF-UHFFFAOYSA-M
Formula
C13H20ClNNaO3P
Mass
327.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Aralkylamines Aryl chlorides Tertiary alcohols 1,2-aminoalcohols Organic metal halides Organophosphorus compounds Organochlorides Organic zwitterions Organic sodium salts Organic oxides Monoalkylamines Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorobenzene - Aralkylamine - Aryl chloride - Aryl halide - Tertiary alcohol - 1,2-aminoalcohol - Organic metal halide - Organic alkali metal salt - Organic nitrogen compound - Organic salt - Organic zwitterion - Aromatic alcohol - Organic sodium salt - Primary amine - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available