Structure Information
Structure

Compound Identification

SMILES

[2H]C1=C([2H])C([2H])=C(C(Cl)=C1[2H])C1([2H])C(C(=O)OC([2H])([2H])[2H])=C(NC(=C1C(=O)OC([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])OC([2H])([2H])C([2H])([2H])N)C([2H])([2H])[2H]

InChIKey

InChIKey=HTIQEAQVCYTUBX-LXWWQOSBSA-N

Formula

C20H25ClN2O5

Mass

431.01

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Halobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Chlorobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Chlorobenzene - Dihydropyridine - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Dialkyl ether - Secondary aliphatic amine - Azacycle - Ether - Enamine - Amine - Primary aliphatic amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Primary amine - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.

External Descriptors

Not available

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