Compound Identification
SMILES
CC1=C(C(=O)C(Cl)=C(Cl)C(O)=O)C2=CC=CC=C2N1
InChIKey
InChIKey=DQWRTOXPKVXGTF-UHFFFAOYSA-N
Formula
C13H9Cl2NO3
Mass
298.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indoles
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Aryl ketones Substituted pyrroles Alpha-branched alpha,beta-unsaturated ketones Benzenoids Vinylogous halides Vinylogous amides Acryloyl compounds Alpha-chloroketones Alpha-halocarboxylic acids Heteroaromatic compounds Enones Vinyl chlorides Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Chloroalkenes Organochlorides Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Aryl ketone - Substituted pyrrole - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Alpha-haloketone - Enone - Heteroaromatic compound - Alpha-halocarboxylic acid or derivatives - Pyrrole - Vinylogous amide - Vinylogous halide - Alpha-halocarboxylic acid - Alpha,beta-unsaturated ketone - Acryloyl-group - Alpha-chloroketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Azacycle - Chloroalkene - Monocarboxylic acid or derivatives - Haloalkene - Vinyl halide - Vinyl chloride - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available