Compound Identification
SMILES
Cl.CCOC(=O)C1=CC=CC=C1C1=CC(OC[C@H](O)CNC(C)(C)CC2=CC3=CC=CC=C3C=C2)=C(C=C1)C#N
InChIKey
InChIKey=BGOKBURQYJMBLD-LNLSOMNWSA-N
Formula
C33H35ClN2O4
Mass
559.1
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
Naphthalenes Benzoic acid esters Phenoxy compounds Phenol ethers Benzoyl derivatives Benzonitriles Alkyl aryl ethers Aralkylamines Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Nitriles Dialkylamines Hydrochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Biphenylcarbonitrile - Benzoate ester - Naphthalene - Benzoic acid or derivatives - Phenoxy compound - Benzonitrile - Benzoyl - Phenol ether - Alkyl aryl ether - Aralkylamine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Secondary alcohol - Carbonitrile - Nitrile - Ether - Secondary aliphatic amine - Secondary amine - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organic oxide - Hydrochloride - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Alcohol - Organonitrogen compound - Organooxygen compound - Aromatic homopolycyclic 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