Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=C(Cl)C=C1.CCCCOC1=CC=CC=C1OCC1CCN(CC(O)COC2=CC=CC3=C2CCN3C=O)CC1

InChIKey

InChIKey=VIEXSSZJHMYCIF-UHFFFAOYSA-N

Formula

C35H43ClN2O7

Mass

639.19

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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

4-halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - Benzoic acid - Indole or derivatives - Benzoyl - Phenoxy compound - Phenol ether - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Piperidine - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Alcohol - Carbonyl group - Organohalogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic oxide - Organochloride - Organic oxygen compound - Aromatic heteropolycyclic 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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