Compound Identification
SMILES
[Na+].[O-]C(=O)C(=C)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=OQKISAQILBECLB-UHFFFAOYSA-M
Formula
C10H7NaO3
Mass
198.153
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Benzoyl derivatives Aryl ketones Beta-keto acids and derivatives Alpha-branched alpha,beta-unsaturated ketones Enones Acryloyl compounds Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Benzoyl - Aryl ketone - Beta-keto acid - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Keto acid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Carboxylic acid salt - Ketone - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic sodium salt - Carbonyl group - Organic oxygen compound - Organic salt - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available