Compound Identification
SMILES
CCOC(=O)CC(CC(=O)OCC)(C#N)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=NRJURUPAVGNABO-UHFFFAOYSA-N
Formula
C16H18ClNO4
Mass
323.77
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
Fatty acid esters Dicarboxylic acids and derivatives Aryl chlorides Carboxylic acid esters Nitriles Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorobenzene - Fatty acid ester - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Fatty acyl - Carboxylic acid ester - Nitrile - Carbonitrile - Carboxylic acid derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - 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