Compound Identification
SMILES
CCOC(=O)C12C(C)C1(CN=C1N2NC=C1C#N)C(C)=O
InChIKey
InChIKey=XNPLBVKYXDVYGU-UHFFFAOYSA-N
Formula
C14H16N4O3
Mass
288.307
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Pyrazolopyrimidines Gamma-keto acids and derivatives 1,3-diazepines Cyclopropanecarboxylic acids and derivatives Hydropyrimidines Imidolactams Pyrazolines Pyrazoles Amidrazones Carboxylic acid esters Ketones Nitriles Amidines Azacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Pyrazolopyrimidine - Gamma-keto acid - Meta-diazepine - Cyclopropanecarboxylic acid or derivatives - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Keto acid - Pyrimidine - Imidolactam - Pyrazoline - Pyrazole - Carboxylic acid amidrazone - Carboxylic acid ester - Ketone - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available