Compound Identification
SMILES
CCOC1=CC(=CNNC(=O)C2=C(OC)C=CC(Br)=C2)C=C(Br)C1=O
InChIKey
InChIKey=GLPVJFDSWVRSAE-UHFFFAOYSA-N
Formula
C17H16Br2N2O4
Mass
472.133
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
Phenoxy compounds P-quinomethanes Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Aryl bromides Alpha-haloketones Carboxylic acid hydrazides Vinyl bromides Bromoalkenes Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - P-quinomethane - Phenol ether - Phenoxy compound - Anisole - Quinomethane - Methoxybenzene - Benzoyl - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Alpha-haloketone - Carboxylic acid hydrazide - Cyclic ketone - Ketone - Bromoalkene - Haloalkene - Carboxylic acid derivative - Vinyl halide - Ether - Vinyl bromide - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - 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