Compound Identification
SMILES
ClC1=C(NC2=CC=C(C=C2)C#N)C(=O)C2C=CC=CC2C1=O
InChIKey
InChIKey=JMHLXCBVHXPFOC-UHFFFAOYSA-N
Formula
C17H11ClN2O2
Mass
310.74
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
Aniline and substituted anilines Secondary alkylarylamines Cyclohexenones Vinylogous halides Vinylogous amides Alpha-chloroketones Vinyl chlorides Nitriles Enamines Chloroalkenes Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Benzonitrile - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Cyclohexenone - Alpha-haloketone - Alpha-chloroketone - Vinylogous halide - Vinylogous amide - Ketone - Enamine - Carbonitrile - Nitrile - Secondary amine - Vinyl chloride - Vinyl halide - Haloalkene - Chloroalkene - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Carbonyl group - Amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homopolycyclic 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