Compound Identification
SMILES
ClC(Cl)(Cl)SN1C(=O)C2=CC=CC=C2C1=O.COCC(=O)N([C@@H](C)C(=O)OC)C1=C(C)C=CC=C1C
InChIKey
InChIKey=MESVPTFSBSVPIR-YDALLXLXSA-N
Formula
C24H25Cl3N2O6S
Mass
575.88
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
Phthalimides Alanine and derivatives Anilides Isoindoles m-Xylenes Tertiary carboxylic acid amides Methyl esters Trihalomethanes Sulfenyl compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides Organonitrogen compounds Alkyl chlorides Organopnictogen compounds
Molecular Framework
Not available
Substituents
Alpha-amino acid ester - Phthalimide - Alanine or derivatives - Isoindolone - Isoindole or derivatives - Isoindole - Isoindoline - Anilide - M-xylene - Xylene - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Methyl ester - Carboxamide group - Trihalomethane - Carboxylic acid ester - Ether - Sulfenyl compound - Monocarboxylic acid or derivatives - Dialkyl ether - Organoheterocyclic compound - Azacycle - Alkyl chloride - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Halomethane - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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