Compound Identification
SMILES
BrC1=CC(C=CC1=O)=NC(=O)C1=CC=CC=C1I
InChIKey
InChIKey=ZMNMITTYIFCKMS-UHFFFAOYSA-N
Formula
C13H7BrINO2
Mass
416.012
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
2-halobenzoic acids and derivatives
Alternative Parents
Benzoyl derivatives Iodobenzenes Aryl iodides Vinylogous halides Alpha-haloketones Secondary ketimines Azomethines Cyclic ketones Vinyl bromides Propargyl-type 1,3-dipolar organic compounds Bromoalkenes Carboxylic acids and derivatives Organopnictogen compounds Organoiodides Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - Benzoyl - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Alpha-haloketone - Azomethine - Secondary ketimine - Vinylogous halide - Cyclic ketone - Ketone - Propargyl-type 1,3-dipolar organic compound - Bromoalkene - Vinyl halide - Vinyl bromide - Haloalkene - Organic 1,3-dipolar compound - Carboxylic acid derivative - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organoiodide - Organic oxide - Organopnictogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
External Descriptors
Not available