Compound Identification
SMILES
O=C(OC1=CC=C(C=C1)C1=CC=C(C=C1)C#N)C1=CN(N=C1C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=CKWPRZPOQQGOCU-UHFFFAOYSA-N
Formula
C29H19N3O2
Mass
441.49
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
Phenylpyrazoles Phenol esters Pyrazole carboxylic acids and derivatives Phenoxy compounds Benzonitriles Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Nitriles Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenylcarbonitrile - Phenylpyrazole - Phenol ester - Phenoxy compound - Benzonitrile - Pyrazole-4-carboxylic acid or derivatives - Azole - Heteroaromatic compound - Vinylogous amide - Pyrazole - Carboxylic acid ester - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - 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