Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(=C1)N(CC(F)CN1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2)S(=O)(=O)C1=CC=CC=C1C(F)(F)F

InChIKey

InChIKey=AJDBUPLHPWJAEE-UHFFFAOYSA-N

Formula

C29H22Br2F4N2O3S

Mass

714.37

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Biphenyls and derivatives

Intermediate Tree Nodes

Brominated biphenyls

Direct Parent

Polybrominated biphenyls

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Polybrominated biphenyl - Carbazole - Benzenesulfonamide - Trifluoromethylbenzene - N-alkylindole - Sulfanilide - Indole - Indole or derivatives - Benzenesulfonyl group - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aryl bromide - Organosulfonic acid amide - Aryl halide - Substituted pyrrole - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Pyrrole - Organic sulfonic acid or derivatives - Ether - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Alkyl halide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as polybrominated biphenyls. These are organic aromatic compounds containing a biphenyl moiety, which is substituted at two or more ring positions by a bromine atom.

External Descriptors

Not available

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