Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=C(Cl)C=C1.CC(C)(C)OC(=O)N1CCCN(CC(C(O)C1)C1CCCCCCCC1)C(=O)OC(C)(C)C

InChIKey

InChIKey=SQGNPTWDCHQEPY-UHFFFAOYSA-N

Formula

C33H53ClN2O7

Mass

625.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

Halobenzoic acids

Alternative Parents

Molecular Framework

Not available

Substituents

Halobenzoic acid - 4-halobenzoic acid - 4-halobenzoic acid or derivatives - Benzoic acid - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carbamic acid ester - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Carboxylic acid - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on the benzene ring.

External Descriptors

Not available

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