Compound Identification
SMILES
ClC1=CC=C(CN2CCC(CC2)(OCC(=O)NC2=CC(Cl)=CC(Cl)=C2)C2=CC=C(C=C2)C2=CC=CC(=C2)C#N)C=C1
InChIKey
InChIKey=OQKSXXXBAAYEPN-UHFFFAOYSA-N
Formula
C33H28Cl3N3O2
Mass
604.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
-
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
Biphenylcarbonitriles
Alternative Parents
N-benzylpiperidines Phenylpiperidines Anilides Benzylethers Benzonitriles Benzylamines Dichlorobenzenes N-arylamides Phenylmethylamines Aralkylamines Aryl chlorides Secondary carboxylic acid amides Trialkylamines Amino acids and derivatives Dialkyl ethers Azacyclic compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenylcarbonitrile - N-benzylpiperidine - Benzylpiperidine - Phenylpiperidine - Benzylether - Anilide - Phenylmethylamine - Benzonitrile - Benzylamine - 1,3-dichlorobenzene - N-arylamide - Aralkylamine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Piperidine - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Nitrile - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Carbonitrile - Organochloride - Amine - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organooxygen compound - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as biphenylcarbonitriles. These are organic compounds containing an acetonitrile with one hydrogen replaced by a biphenyl group.
External Descriptors
Not available