Compound Identification
SMILES
CC1=C(NC2=CC3=C(OCO3)C=C2)C=CC(=C1)C#N
InChIKey
InChIKey=CZOXMRJEBLHXJO-UHFFFAOYSA-N
Formula
C15H12N2O2
Mass
252.273
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Benzonitriles Aniline and substituted anilines Aminotoluenes Secondary amines Oxacyclic compounds Nitriles Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Benzonitrile - Aniline or substituted anilines - Aminotoluene - Toluene - Monocyclic benzene moiety - Benzenoid - Acetal - Carbonitrile - Nitrile - Secondary amine - Oxacycle - Organonitrogen compound - Amine - Organopnictogen compound - Organooxygen compound - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available