Compound Identification
SMILES
O=C(\C=C\C1=CC=C(OCC#N)C=C1)C1=CC2=C(OCC(=O)N2)C=C1
InChIKey
InChIKey=GSVXGJNDFUIONB-XVNBXDOJSA-N
Formula
C19H14N2O4
Mass
334.331
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
Cinnamic acids and derivatives Benzoxazinones Benzomorpholines Styrenes Phenoxy compounds Phenol ethers Aryl ketones Alkyl aryl ethers Acryloyl compounds Enones Secondary carboxylic acid amides Lactams Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzoxazinone - Benzomorpholine - Benzoxazine - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Alkyl aryl ether - Oxazinane - Monocyclic benzene moiety - Benzenoid - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Carboxamide group - Secondary carboxylic acid amide - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Nitrile - Carbonitrile - Organic oxygen compound - Carbonyl group - Cyanide - Organooxygen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic 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