Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC=C2C(CCCS(=O)(=O)NC3=CC=C(Cl)C=C3)=CC(C(O)=O)=C2C=C1

InChIKey

InChIKey=VEMJQFPYGMUDGO-UHFFFAOYSA-N

Formula

C23H24ClNO4S

Mass

445.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Hydrocarbons

Class

Unsaturated hydrocarbons

Subclass

Olefins

Intermediate Tree Nodes

Cyclic olefins

Direct Parent

Azulenes

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Azulene - Sulfanilide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as azulenes. These are polycyclic aromatic compounds containing the azulene skeleton, which consists of the cyclopentadiene ring fused to a cycloheptadiene ring.

External Descriptors

Not available

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