Compound Identification
SMILES
COC1=C(C=C(Br)C=C1)C(=O)N(C(=O)C1=C(OC)C=CC(Br)=C1)C1=C(C)C=CC=N1
InChIKey
InChIKey=OFQIMKDZQZHLLF-UHFFFAOYSA-N
Formula
C22H18Br2N2O4
Mass
534.204
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 Anisoles Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Bromobenzenes Methylpyridines Aryl bromides N-substituted carboxylic acid imides Imidolactams Heteroaromatic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Halobenzene - Alkyl aryl ether - Bromobenzene - Methylpyridine - Imidolactam - Aryl bromide - Pyridine - Carboxylic acid imide, n-substituted - Aryl halide - Carboxylic acid imide - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic 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