Structure Information
Structure

Compound Identification

SMILES

COCC1=NC(=C(COC)N=C1NC1CN(CC1OCCF)C(=O)OC)C1=C(Cl)C=C(Cl)C=C1

InChIKey

InChIKey=UFTWGFIXGAUFJW-UHFFFAOYSA-N

Formula

C22H27Cl2FN4O5

Mass

517.38

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,3-dichlorobenzene - Pyrrolidine carboxylic acid - Aminopyrazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrazine - Benzenoid - Imidolactam - Methylcarbamate - Heteroaromatic compound - Carbamic acid ester - Azacycle - Dialkyl ether - Ether - Organooxygen compound - Organic oxide - Organohalogen compound - Organic oxygen compound - Organochloride - Organic nitrogen compound - Carbonyl group - Amine - Alkyl halide - Hydrocarbon derivative - Organofluoride - Alkyl fluoride - Organonitrogen compound - 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

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