Compound Identification
SMILES
CCOC(=O)[C@H]1NC2=C(C=C(Cl)C=C2)[C@H]2OCC[C@@H]12
InChIKey
InChIKey=GHKJKXIMOFTAGT-XDTLVQLUSA-N
Formula
C14H16ClNO3
Mass
281.74
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
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Level 6
Alpha amino acids and derivatives
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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
Hydroquinolines Secondary alkylarylamines Aralkylamines Aryl chlorides Benzenoids Tetrahydrofurans Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Tetrahydroquinoline - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl chloride - Aryl halide - Benzenoid - Tetrahydrofuran - Carboxylic acid ester - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Secondary amine - Azacycle - Organoheterocyclic compound - Organohalogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - Aromatic 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