Compound Identification
SMILES
OC(=O)C1=C(O)C=C(OCC2=CC=C(C=C2)C2=CC=CC=C2C#N)C=C1
InChIKey
InChIKey=RPOIPJQBZQIOOX-UHFFFAOYSA-N
Formula
C21H15NO4
Mass
345.354
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
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Subclass
Biphenyls and derivatives
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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
Salicylic acids Benzoic acids Phenoxy compounds Phenol ethers Benzoyl derivatives Benzonitriles Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Nitriles Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Biphenylcarbonitrile - Hydroxybenzoic acid - Salicylic acid or derivatives - Salicylic acid - Benzoic acid - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Phenol ether - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Vinylogous acid - Carboxylic acid derivative - Nitrile - Carbonitrile - Carboxylic acid - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Aromatic homomonocyclic 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