Compound Identification
SMILES
CC1=C(C=C(Cl)C(=C1)C1=CC(=CC=C1)C(N)=O)C1=C(N)C2(CCCN(CC(=O)NCC3=CC=CC=C3)C2)OC1=O
InChIKey
InChIKey=YVOHMJDIXZLMCX-UHFFFAOYSA-N
Formula
C31H31ClN4O4
Mass
559.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- 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
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
Alpha amino acid amides Azaspirodecane derivatives Benzamides Benzoyl derivatives Toluenes Chlorobenzenes Aryl chlorides Butenolides Piperidines Enoate esters Vinylogous amides Lactones Primary carboxylic acid amides Secondary carboxylic acid amides Trialkylamines Monocarboxylic acids and derivatives Enamines Azacyclic compounds Oxacyclic compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - Alpha-amino acid amide - Alpha-amino acid or derivatives - Azaspirodecane - Benzamide - Benzoic acid or derivatives - Benzoyl - Toluene - Halobenzene - Chlorobenzene - 2-furanone - Piperidine - Aryl halide - Aryl chloride - Dihydrofuran - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Primary carboxylic acid amide - Lactone - Monocarboxylic acid or derivatives - Oxacycle - Enamine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organic oxygen compound - Organohalogen compound - Primary aliphatic amine - Organooxygen compound - Organochloride - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - 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