Compound Identification
SMILES
CNC[C@H](CC(C)C)NC(=O)N1CCC[C@H](C1)[C@@](O)(CCCCOC)C1=CC=CC=C1C1=CC=CC=C1Cl
InChIKey
InChIKey=WQHREPYDEIWHPP-QOMXPILVSA-N
Formula
C31H46ClN3O3
Mass
544.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Chlorinated biphenyls
-
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
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
Piperidinecarboxamides Chlorobenzenes Aryl chlorides Tertiary alcohols Ureas Tertiary amines Dialkylamines Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Chlorinated biphenyl - 1-piperidinecarboxamide - Piperidinecarboxamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Piperidine - Tertiary alcohol - Urea - Tertiary amine - Secondary amine - Dialkyl ether - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Azacycle - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alcohol - Aromatic heteromonocyclic 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