Compound Identification
SMILES
CCCCCC1=CC=C(C=C1)C(=O)N(CC1=CC=C(C=C1)C1=CC=C(C=C1)C#N)C1CCN(CC2=COC=C2)CC1
InChIKey
InChIKey=VTDYEQLGCHXGAT-UHFFFAOYSA-N
Formula
C36H39N3O2
Mass
545.727
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
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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
Biphenylcarbonitriles
Alternative Parents
Benzamides Benzonitriles Benzoyl derivatives Aralkylamines Piperidines Tertiary carboxylic acid amides Heteroaromatic compounds Furans Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Nitriles Organic oxides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenylcarbonitrile - Benzamide - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Aralkylamine - Piperidine - Heteroaromatic compound - Furan - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonitrile - Nitrile - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Organic oxide - Organonitrogen compound - Organooxygen compound - 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