Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C(=O)OC)C2(C3=C(C=CC(Br)=C3)C3=C2C=C(Br)C=C3)C2(\C=C\C3=CC=C(Cl)C=C3)N1CCC1=CC(OC)=C(OC)C=C21

InChIKey

InChIKey=VNLNRFRGWJMFHY-FYWRMAATSA-N

Formula

C38H30Br2ClNO6

Mass

791.92

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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 - Fluorene - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Phenol ether - Anisole - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Styrene - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Aryl chloride - Dicarboxylic acid or derivatives - Aryl bromide - Aryl halide - Vinylogous amide - Pyrroline - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Enamine - Ether - Organonitrogen compound - Amine - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organobromide - Organic oxide - Hydrocarbon derivative - Organohalogen compound - 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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