Compound Identification
SMILES
OC(=O)NC1(CC1)C(C=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=NKNASMSKZBUGTH-UHFFFAOYSA-N
Formula
C12H12ClNO3
Mass
253.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylacetaldehydes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylacetaldehydes
Intermediate Tree Nodes
Not available
Direct Parent
Phenylacetaldehydes
Alternative Parents
Chlorobenzenes Aryl chlorides Carbamic acids Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylacetaldehyde - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carbamic acid - Carbamic acid derivative - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Aldehyde - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylacetaldehydes. These are compounds containing a phenylacetaldehyde moiety, which consists of a phenyl group substituted at the second position by an acetalydehyde.
External Descriptors
Not available