Compound Identification
SMILES
[2H]C1=C([2H])C([2H])=C(NC2=C(Cl)C=CC=C2Cl)C(CC(=O)O[13CH2][13C](O)=O)=C1[2H]
InChIKey
InChIKey=MNIPYSSQXLZQLJ-UVMBEDSSSA-N
Formula
C16H13Cl2NO4
Mass
360.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
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Level 5
Chlorobenzenes
- Level 6 Dichlorobenzenes
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Level 5
Chlorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
Aniline and substituted anilines Primary aromatic amines Dicarboxylic acids and derivatives Aryl chlorides Carboxylic acid esters Amino acids Secondary amines Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aniline or substituted anilines - 1,3-dichlorobenzene - Aryl chloride - Aryl halide - Primary aromatic amine - Dicarboxylic acid or derivatives - Amino acid or derivatives - Amino acid - Carboxylic acid ester - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors
Not available