Compound Identification
SMILES
CC(C)(C)C(=O)C=CNC1=CC(=C(Cl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=ZJCIFCSBLLRAPV-UHFFFAOYSA-N
Formula
C13H15ClN2O3
Mass
282.72
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
Aniline and substituted anilines Nitroaromatic compounds Chlorobenzenes Aryl chlorides Vinylogous amides Acryloyl compounds Enones Ketones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Enamines Allylamines Hydrocarbon derivatives Organic salts Organic zwitterions Organochlorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Vinylogous amide - Organic nitro compound - Ketone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Enamine - Allylamine - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Amine - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic salt - 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