Compound Identification
SMILES
CCCOC1=CC=C(C=C1)C(C#N)C(=O)C(=O)OCC
InChIKey
InChIKey=CGBMQZFCYWMDPB-UHFFFAOYSA-N
Formula
C15H17NO4
Mass
275.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpyruvic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyruvic acid derivatives
Alternative Parents
Phenoxy compounds Phenol ethers Fatty acid esters Alkyl aryl ethers Alpha-keto acids and derivatives Ketones Carboxylic acid esters Nitriles Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylpyruvate - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fatty acid ester - Alpha-keto acid - Keto acid - Fatty acyl - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Cyanide - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyruvic acid derivatives. These are compounds containing a phenylpyruvic acid moiety, which consists of a phenyl group substituted at the second position by an pyruvic acid.
External Descriptors
Not available