Compound Identification
SMILES
CC(C)C(=O)C(O)(CN1C=NC=N1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=YOVWXHDIJVHRLM-UHFFFAOYSA-N
Formula
C14H16ClN3O2
Mass
293.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
-
Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Aryl chlorides Acyloins Triazoles Tertiary alcohols Heteroaromatic compounds Alpha-hydroxy ketones Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Chlorobenzene - Acyloin - Aryl chloride - Aryl halide - Alpha-hydroxy ketone - Heteroaromatic compound - Azole - 1,2,4-triazole - Tertiary alcohol - Ketone - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Aromatic alcohol - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available