Compound Identification
SMILES
C[C@@H]1CCC[N+]1(C(O)=O)C(=O)CC(SC(C)=O)C(=O)C1=CC=C(Cl)S1
InChIKey
InChIKey=AYADPWCKVWIZII-OLYGUKFQSA-O
Formula
C16H19ClNO5S2
Mass
404.9
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
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Subclass
Pyrrolidine carboxylic acids and derivatives
- Level 5 Pyrrolidine carboxylic acids
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Subclass
Pyrrolidine carboxylic acids and derivatives
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Pyrrolidine carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolidine carboxylic acids
Alternative Parents
N-acylpyrrolidines Aryl alkyl ketones 2,5-disubstituted thiophenes Aryl chlorides Quaternary ammonium salts Heteroaromatic compounds Thioesters Carbothioic S-esters Carbamic acids and derivatives Sulfenyl compounds Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acylpyrrolidine - Pyrrolidine carboxylic acid - Aryl ketone - Aryl alkyl ketone - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Heteroaromatic compound - Quaternary ammonium salt - Thiophene - Carbamic acid derivative - Carbothioic s-ester - Ketone - Thiocarboxylic acid ester - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolidine carboxylic acids. These are compounds containing a pyrrolidine ring which bears a carboxylic acid. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available