Compound Identification
SMILES
[O-][N+](=O)C1=CC(C=CC=O)=C(Cl)C=C1
InChIKey
InChIKey=YGRWDGMIJOLYCX-UHFFFAOYSA-N
Formula
C9H6ClNO3
Mass
211.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Cinnamaldehydes
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamaldehydes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamaldehydes
Alternative Parents
Nitrobenzenes Styrenes Nitroaromatic compounds Chlorobenzenes Aryl chlorides Enals Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Aldehydes Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamaldehyde - Nitrobenzene - Nitroaromatic compound - Styrene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated aldehyde - Enal - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organooxygen compound - Organic nitrogen compound - Aldehyde - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamaldehydes. These are organic aromatic compounds containing a cinnamlaldehyde moiety, consisting of a benzene and an aldehyde group to form 3-phenylprop-2-enal.
External Descriptors
Not available