Compound Identification
SMILES
CN1C=CN=C1CC[C@@]1(OC[C@H](CO)O1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=XXJLKTJQGZBPBG-HOCLYGCPSA-N
Formula
C16H19ClN2O3
Mass
322.79
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
Ketals N-substituted imidazoles Aryl chlorides Heteroaromatic compounds 1,3-dioxolanes Oxacyclic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Chlorobenzene - Ketal - Aryl chloride - Aryl halide - N-substituted imidazole - Meta-dioxolane - Azole - Imidazole - Heteroaromatic compound - Acetal - Organoheterocyclic compound - Azacycle - Oxacycle - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Alcohol - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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