Compound Identification
SMILES
CC(NC(C)=O)S(=O)C1(Cl)CC2CC(=O)N2C1C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=RWHJSVHYVSITJI-UHFFFAOYSA-N
Formula
C18H21ClN2O5S
Mass
412.89
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
Carbapenams Benzyloxycarbonyls Caprolactams Pyrrolidine carboxylic acids Azepanes Acetamides Tertiary carboxylic acid amides Carboxylic acid esters Sulfoxides Azetidines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Sulfinyl compounds Alkyl chlorides Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Carbapenam - Benzyloxycarbonyl - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Caprolactam - Azepane - Benzenoid - Monocyclic benzene moiety - Beta-lactam - Tertiary carboxylic acid amide - Pyrrolidine - Acetamide - Carboxamide group - Sulfoxide - Secondary carboxylic acid amide - Carboxylic acid ester - Lactam - Azetidine - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Monocarboxylic acid or derivatives - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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