Compound Identification
SMILES
OC(=O)C(F)(F)F.CCN1C(=O)[C@H]2[C@H](N[C@](CC3=CC=CC=C3)([C@H]2C1=O)C(=O)OC)C1=CC=C(C=C1)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=IOAJCCANRFPTKA-OANXMZBQSA-N
Formula
C31H27Cl2F3N2O6
Mass
651.46
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
Chlorinated biphenyls
- Level 6 Polychlorinated biphenyls
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Level 5
Chlorinated biphenyls
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Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Chlorinated biphenyls
Direct Parent
Polychlorinated biphenyls
Alternative Parents
Alpha amino acid esters Phenylpyrrolidines Amphetamines and derivatives Dichlorobenzenes Pyrrolidine carboxylic acids Aralkylamines Fatty acid esters Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Aryl chlorides Alpha-halocarboxylic acids Methyl esters Dicarboximides Pyrroles Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Not available
Substituents
Polychlorinated biphenyl - Alpha-amino acid ester - 2-phenylpyrrolidine - Alpha-amino acid or derivatives - Amphetamine or derivatives - 1,2-dichlorobenzene - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Chlorobenzene - Fatty acid ester - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Fatty acyl - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Pyrrolidine - Alpha-halocarboxylic acid or derivatives - Pyrrole - Methyl ester - Alpha-halocarboxylic acid - Carboxylic acid imide - Dicarboximide - Amino acid or derivatives - Carboxylic acid ester - Lactam - Azacycle - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Organoheterocyclic compound - Carboxylic acid - Secondary amine - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic oxide - Amine - Organohalogen compound - Organochloride - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as polychlorinated biphenyls. These are organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available