Structure Information
Structure

Compound Identification

SMILES

CCCCC1=NC(SC2CCCCC2)=C(N1CC1=CC2=C(OCO2)C=C1Cl)C(O)=O

InChIKey

InChIKey=AJJVAUWWVRIJTP-UHFFFAOYSA-N

Formula

C22H27ClN2O4S

Mass

450.98

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,2,4,5-tetrasubstituted imidazole - Benzodioxole - Aryl thioether - Imidazole-4-carbonyl group - Alkylarylthioether - Aryl chloride - Aryl halide - Vinylogous thioester - Benzenoid - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Acetal - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Sulfenyl compound - Thioether - Organopnictogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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