Compound Identification
SMILES
CCOC1=CC=CC=C1C1=CC(OC)=C(C=C1Cl)C(=O)N1CC2=CC=C(N2CC2=CC=CC=C12)C(=O)N(C)C1(C)CCNCC1
InChIKey
InChIKey=AQCDPVDVNRMEPA-UHFFFAOYSA-N
Formula
C36H39ClN4O4
Mass
627.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Biphenyls and derivatives
- Level 5 Chlorinated 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
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
1,4-benzodiazepines 3-halobenzoic acids and derivatives Benzamides Anisoles Benzoyl derivatives Methoxybenzenes 2-heteroaryl carboxamides Pyrrole carboxamides Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Substituted pyrroles Aryl chlorides Piperidines Heteroaromatic compounds Tertiary carboxylic acid amides Amino acids and derivatives Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - Benzodiazepine - 1,4-benzodiazepine - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Anisole - 2-heteroaryl carboxamide - Phenoxy compound - Benzoyl - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Substituted pyrrole - Aryl halide - Piperidine - Aryl chloride - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Organochloride - Amine - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorinated biphenyls. These are organic compounds containing at least one chlorine atom attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available