Compound Identification
SMILES
[O-][N+](=O)C1=C(Cl)C=C(C2=CC=C(O2)C=C(C#N)C(=O)C2=CC=CC=C2)C(Cl)=C1
InChIKey
InChIKey=PPERQOZRSZYSCH-UHFFFAOYSA-N
Formula
C20H10Cl2N2O4
Mass
413.21
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
-
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
Nitrobenzenes Aryl ketones Benzoyl derivatives Dichlorobenzenes Nitroaromatic compounds Alpha-branched alpha,beta-unsaturated ketones Aryl chlorides Acryloyl compounds Enones Furans Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Nitriles Aldehydes Organic salts Organochlorides Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Nitrobenzene - Nitroaromatic compound - Aryl ketone - 1,4-dichlorobenzene - Benzoyl - Halobenzene - Chlorobenzene - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Heteroaromatic compound - Acryloyl-group - Furan - Enone - Alpha,beta-unsaturated ketone - Organic nitro compound - C-nitro compound - Ketone - Nitrile - Carbonitrile - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Aldehyde - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Cyanide - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic 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