Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C2=C(C=C1)C=C(SC2=O)C(=O)OC1=C(C=O)C=CC(Br)=C1

InChIKey

InChIKey=OACJZBQOBPTGHI-UHFFFAOYSA-N

Formula

C19H13BrO6S

Mass

449.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isothiochromenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Isothiochromenes

Alternative Parents

Phenol esters 2-benzothiopyrans Phenoxy compounds Anisoles Benzoyl derivatives Benzaldehydes Alkyl aryl ethers Bromobenzenes Aryl bromides Vinylogous esters Heteroaromatic compounds Carbothioic S-lactones Carboxylic acid esters Hydrocarbon derivatives Organic oxides Organobromides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isothiochromene - Phenol ester - Benzothiopyran - 2-benzothiopyran - Phenoxy compound - Benzaldehyde - Phenol ether - Benzoyl - Anisole - Aryl-aldehyde - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous ester - Carbothioic s-lactone - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organobromide - Organooxygen compound - Organic oxide - Organic oxygen compound - Aldehyde - Hydrocarbon derivative - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isothiochromenes. These are organic heterocyclic compounds containing an isothiochromene moiety.

External Descriptors

Not available

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