Compound Identification
SMILES
O=C(C=CC1=CC=C(C=C1)N1CCOCC1)C1=CC=C(C=C1)S(=O)(=O)N1CCCCCC1
InChIKey
InChIKey=QZKZOBNKMIOITM-UHFFFAOYSA-N
Formula
C25H30N2O4S
Mass
454.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Phenylmorpholines Cinnamic acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Styrenes Aniline and substituted anilines Aryl ketones Dialkylarylamines Benzoyl derivatives Azepanes Organosulfonamides Sulfonyls Acryloyl compounds Enones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Phenylmorpholine - Cinnamic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Styrene - Aryl ketone - Dialkylarylamine - Aniline or substituted anilines - Benzoyl - Azepane - Monocyclic benzene moiety - Oxazinane - Benzenoid - Morpholine - Organosulfonic acid amide - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Ketone - Tertiary amine - Azacycle - Ether - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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