Compound Identification
SMILES
CC1=CC(=NOC(=O)C2=CC=C(Cl)C=C2)C(Br)C(C)(Br)C1=O
InChIKey
InChIKey=GQRVXKCKJYZQKF-UHFFFAOYSA-N
Formula
C15H12Br2ClNO3
Mass
449.52
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
4-halobenzoic acids and derivatives
Alternative Parents
Benzoyl derivatives Cyclohexenones Chlorobenzenes Aryl chlorides Oxime esters Alpha-haloketones Carboxylic acids and derivatives Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
4-halobenzoic acid or derivatives - Benzoyl - Cyclohexenone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Alpha-haloketone - Oximester - Cyclic ketone - Ketone - Carboxylic acid derivative - Alkyl bromide - Organobromide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available