Compound Identification
SMILES
OC(=O)C(=O)\C=C(/O)C1=CN(CC2=CC=CC(=C2)C#N)C=C1
InChIKey
InChIKey=ZPHHXEMLLBFCMJ-AUWJEWJLSA-N
Formula
C16H12N2O4
Mass
296.282
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Substituted pyrroles Alpha-keto acids and derivatives Vinylogous acids Heteroaromatic compounds Enones Alpha-hydroxy ketones Acryloyl compounds Nitriles Monocarboxylic acids and derivatives Enols Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Alpha-keto acid - Keto acid - Substituted pyrrole - Acryloyl-group - Alpha-hydroxy ketone - Enone - Heteroaromatic compound - Vinylogous acid - Alpha,beta-unsaturated ketone - Pyrrole - Ketone - Carboxylic acid derivative - Carboxylic acid - Enol - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available