Compound Identification
SMILES
[O-][N+](=O)OOC(=O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=IBDKIXHPVYWORD-UHFFFAOYSA-N
Formula
C7H4ClNO5
Mass
217.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
3-halobenzoic acids and derivatives
Alternative Parents
Peroxybenzoic acids and derivatives Benzoyl derivatives Chlorobenzenes Aryl chlorides Organic peroxynitrates Peroxycarboxylic acids and derivatives Organic nitrates Organic nitric acids and derivatives Organic nitro compounds Organooxygen compounds Organic nitrogen compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Peroxybenzoate - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Organic peroxynitrate - Organic nitrate - Peroxycarboxylic acid or derivatives - Organic nitro compound - Organic nitric acid or derivatives - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organochloride - Organooxygen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available