Compound Identification
SMILES
CN(C)C1=C(C=C(C=CC(=O)C2=CC=C(C=C2)N2CCOCC2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=OJYIVWRSCCSUJK-UHFFFAOYSA-N
Formula
C21H23N3O4
Mass
381.432
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
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Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives Phenylmorpholines Nitrobenzenes Aniline and substituted anilines Aryl ketones Benzoyl derivatives Styrenes Dialkylarylamines Nitroaromatic compounds Enones Acryloyl compounds Azacyclic compounds Dialkyl ethers Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Phenylmorpholine - Cinnamic acid or derivatives - Nitrobenzene - Tertiary aliphatic/aromatic amine - Styrene - Aryl ketone - Nitroaromatic compound - Dialkylarylamine - Aniline or substituted anilines - Benzoyl - Oxazinane - Benzenoid - Monocyclic benzene moiety - Morpholine - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Ketone - C-nitro compound - Organic nitro compound - Tertiary amine - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Dialkyl ether - Organic oxoazanium - Oxacycle - Ether - Azacycle - Organic zwitterion - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available