Compound Identification
SMILES
CC1=CC=CC=C1C(=O)NC(OC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C(Cl)(Cl)Cl
InChIKey
InChIKey=JDCPAPDQSRLQFD-UHFFFAOYSA-N
Formula
C16H12Cl3N3O6
Mass
448.64
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
o-Toluamides Benzamides Benzoyl derivatives Nitroaromatic compounds Phenol ethers Phenoxy compounds Secondary carboxylic acid amides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organochlorides Organic zwitterions Organic salts Organic oxides Organooxygen compounds Alkyl chlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - O-toluamide - Toluamide - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Toluene - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organochloride - Organonitrogen compound - Organohalogen compound - Hydrocarbon derivative - Alkyl halide - Organooxygen compound - Alkyl chloride - Organic oxide - Organic oxygen compound - Organic zwitterion - Organic nitrogen compound - 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