Compound Identification
SMILES
ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O.COCC(=O)N([C@@H](C)C(=O)OC)C1=C(C)C=CC=C1C
InChIKey
InChIKey=RSZVKQDECFHDQJ-YDALLXLXSA-N
Formula
C24H29Cl3N2O6S
Mass
579.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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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
Alanine and derivatives Isoindolones Anilides m-Xylenes Pyrrolidine-2-ones Tertiary carboxylic acid amides Methyl esters Dicarboximides Trihalomethanes Lactams Sulfenyl compounds Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Not available
Substituents
Alpha-amino acid ester - Alanine or derivatives - Isoindolone - Anilide - Isoindole or derivatives - Isoindoline - M-xylene - Xylene - Benzenoid - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Dicarboximide - Trihalomethane - Lactam - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Halomethane - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - 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