Compound Identification
SMILES
COC1=C(C=C(Cl)C(=C1)C1=CC=CC=C1C)C(=O)N1CC2=CC=C(N2CC2=CC=CC=C12)C(=O)N1CCN(CCCN(C)C)CC1
InChIKey
InChIKey=YOHAULAUPLDRKH-UHFFFAOYSA-N
Formula
C37H42ClN5O3
Mass
640.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
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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 2-heteroaryl carboxamides Pyrrole carboxamides Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Toluenes Alkyl aryl ethers N-alkylpiperazines Chlorobenzenes Substituted pyrroles Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - 1,4-benzodiazepine - Benzodiazepine - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - Benzoyl - Methoxybenzene - Anisole - Phenoxy compound - 2-heteroaryl carboxamide - Phenol ether - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxamide - N-alkylpiperazine - Alkyl aryl ether - Chlorobenzene - Toluene - Halobenzene - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary amine - Carboxamide group - Amino acid or derivatives - Tertiary aliphatic amine - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organochloride - 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