Compound Identification
SMILES
CC(C)OC1=C(Cl)C=C(C=C1)C1=NOC(=N1)C1=CC=C(C=C1)S(=O)(=O)N(CC(O)=O)CC(=O)OC(C)(C)C
InChIKey
InChIKey=PMHFMLYLYXWYJS-UHFFFAOYSA-N
Formula
C25H28ClN3O8S
Mass
566.02
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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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
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Subclass
Amino acids, peptides, and analogues
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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
Phenyloxadiazoles Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Alkyl aryl ethers Chlorobenzenes Aryl chlorides Organosulfonamides Dicarboxylic acids and derivatives Aminosulfonyl compounds Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Carboxylic acids Azacyclic compounds Organochlorides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Phenyl-1,2,4-oxadiazole - Benzenesulfonamide - Benzenesulfonyl group - Phenol ether - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Dicarboxylic acid or derivatives - Aryl halide - Organosulfonic acid amide - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Aminosulfonyl compound - 1,2,4-oxadiazole - Oxadiazole - Azole - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Ether - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organochloride - Hydrocarbon derivative - Organohalogen compound - Aromatic heteromonocyclic 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