Compound Identification
SMILES
ClC(Cl)(Cl)C(OCC#C)OC(=O)CN1C(=O)SC2=CC=CC=C12
InChIKey
InChIKey=FNFLLUMKRAWHFC-UHFFFAOYSA-N
Formula
C14H10Cl3NO4S
Mass
394.65
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
-
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
Benzothiazoles Benzenoids Thiazoles Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Acetylides Acetals Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Alkyl chlorides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - 1,3-benzothiazole - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Carboxylic acid ester - Acetylide - Azacycle - Organoheterocyclic compound - Acetal - Monocarboxylic acid or derivatives - Alkyl halide - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Alkyl chloride - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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