Compound Identification
SMILES
CC1=CC(C)=C(C=C1)[C@@H]1OC(=O)N[C@H]1C#N
InChIKey
InChIKey=JSWZQIKSAIQQEI-QWRGUYRKSA-N
Formula
C12H12N2O2
Mass
216.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Xylenes
Intermediate Tree Nodes
Not available
Direct Parent
m-Xylenes
Alternative Parents
Oxazolidinones Carbamate esters Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
M-xylene - Oxazolidinone - Oxazolidine - Carbamic acid ester - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Oxacycle - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions.
External Descriptors
Not available