Compound Identification
SMILES
COC(=O)CCN(CCO)CC#N
InChIKey
InChIKey=BKQUFNJLMGRJHL-UHFFFAOYSA-N
Formula
C8H14N2O3
Mass
186.211
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Carboxylic acid derivatives
-
Level 5
Carboxylic acid esters
- Level 6 Methyl esters
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Level 5
Carboxylic acid esters
-
Subclass
Carboxylic acid derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid esters
Direct Parent
Methyl esters
Alternative Parents
Trialkylamines Amino acids and derivatives Alpha-aminonitriles 1,2-aminoalcohols Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Methyl ester - 1,2-aminoalcohol - Amino acid or derivatives - Alpha-aminonitrile - Tertiary aliphatic amine - Tertiary amine - Alkanolamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Cyanide - Amine - Organic oxygen compound - Alcohol - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl group.
External Descriptors
Not available