Compound Identification
SMILES
CCOC(=O)CC(C)(O)C#N
InChIKey
InChIKey=NRQQCDLVGWWNRQ-UHFFFAOYSA-N
Formula
C7H11NO3
Mass
157.169
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
- Subclass Fatty acid esters
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Fatty acid esters
Alternative Parents
Tertiary alcohols Cyanohydrins Carboxylic acid esters Alpha-hydroxynitriles Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Fatty acid ester - Tertiary alcohol - Carboxylic acid ester - Cyanohydrin - Alpha-hydroxynitrile - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Alcohol - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors
Not available