Compound Identification
SMILES
O[C@@H]1C[C@H](OC(=O)C1)\C=C\C1=C(Cl)C=C(Cl)C=C1OCC1=CC=C(C=C1)C#N
InChIKey
InChIKey=JUNJVPLXYNEFDV-SDKBWNRFSA-N
Formula
C21H17Cl2NO4
Mass
418.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
-
Level 5
Chlorobenzenes
- Level 6 Dichlorobenzenes
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Level 5
Chlorobenzenes
-
Subclass
Halobenzenes
-
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
Styrenes Phenoxy compounds Phenol ethers Benzonitriles Alkyl aryl ethers Delta valerolactones Oxanes Aryl chlorides Secondary alcohols Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Nitriles Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Benzonitrile - 1,3-dichlorobenzene - Styrene - Phenol ether - Alkyl aryl ether - Delta valerolactone - Delta_valerolactone - Aryl chloride - Aryl halide - Oxane - Carboxylic acid ester - Lactone - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Alcohol - Organochloride - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organonitrogen compound - Aromatic heteromonocyclic 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