Compound Identification
SMILES
CC(=O)NC1=C(OC2=C1C=CC(=C2)C1=CC=CC(=C1)C#N)C(=O)C1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=PULMWNPTWMFWDT-UHFFFAOYSA-N
Formula
C24H14Cl2N2O3
Mass
449.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Phenylbenzofurans Aryl-phenylketones N-acetylarylamines Benzonitriles Benzoyl derivatives Dichlorobenzenes Aryl chlorides Vinylogous amides Heteroaromatic compounds Furans Acetamides Vinylogous halides Secondary carboxylic acid amides Nitriles Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenylbenzofuran - Aryl-phenylketone - N-acetylarylamine - Benzofuran - 1,3-dichlorobenzene - Benzonitrile - Benzoyl - N-arylamide - Aryl ketone - Halobenzene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Vinylogous amide - Vinylogous halide - Heteroaromatic compound - Furan - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Ketone - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Nitrile - Carbonitrile - Organooxygen compound - Organic nitrogen compound - Aldehyde - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available