Compound Identification
SMILES
O[C@@H]([C@@H](COC(=O)CCC([O-])=O)NC(=O)C(Cl)Cl)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=LIRCDOVJWUGTMW-ZWNOBZJWSA-M
Formula
C15H15Cl2N2O8
Mass
422.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Nitroaromatic compounds Fatty acid esters Dicarboxylic acids and derivatives Carboxylic acid esters Carboxylic acid salts Secondary carboxylic acid amides Secondary alcohols Carboxylic acids Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Alkyl chlorides Carbonyl compounds Aromatic alcohols Organic oxides Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Alkyl halide - Organohalogen compound - Aromatic alcohol - Organic salt - Hydrocarbon derivative - Alkyl chloride - Organic oxide - Organic oxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available