Compound Identification
SMILES
CC(C)(C)OC(=O)N1CCN(CC(O)CN2C3=C(C=C(Br)C=C3)C3=C2C=CC(Br)=C3)CC1
InChIKey
InChIKey=QURQMIHUXXYJIT-UHFFFAOYSA-N
Formula
C24H29Br2N3O3
Mass
567.322
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
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Level 5
Brominated biphenyls
- Level 6 Polybrominated biphenyls
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Level 5
Brominated biphenyls
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Subclass
Biphenyls and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
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
Carbazoles N-alkylindoles Indoles Piperazine carboxylic acids N-alkylpiperazines Substituted pyrroles Aryl bromides Heteroaromatic compounds Carbamate esters 1,2-aminoalcohols Trialkylamines Secondary alcohols Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Polybrominated biphenyl - Carbazole - N-alkylindole - Indole - Indole or derivatives - Piperazine-1-carboxylic acid - N-alkylpiperazine - Aryl bromide - Aryl halide - 1,4-diazinane - Piperazine - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Carbamic acid ester - Tertiary amine - 1,2-aminoalcohol - Secondary alcohol - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Alcohol - Organobromide - Organonitrogen compound - Organooxygen 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