Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)C1CC(OCCN(CCO)S(=O)(=O)C2=CC=C(OC)C=C2)OC(=C1)C(=O)NCC1=NC2=CC=CC=C2N1

InChIKey

InChIKey=HDQKKKMGTXNYSG-UHFFFAOYSA-N

Formula

C33H36N4O9S

Mass

664.73

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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

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzenesulfonamide - Benzoate ester - Benzimidazole - Benzenesulfonyl group - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Alkyl aryl ether - Organosulfonic acid amide - Heteroaromatic compound - Azole - Imidazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Methyl ester - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Organoheterocyclic compound - Azacycle - Acetal - Oxacycle - Monocarboxylic acid or derivatives - Alkanolamine - Ether - Carboxylic acid derivative - Primary alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Organonitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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