Compound Identification
SMILES
O=C(NCC1=CC=NC=C1)C1=C2OCCC(NCC3=CN=CN3CC3=CC=C(C=C3)C3=CC=CC=C3C#N)C2=CC=C1
InChIKey
InChIKey=HXOGSLWIDURGGP-UHFFFAOYSA-N
Formula
C34H30N6O2
Mass
554.654
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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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
1-benzopyrans Benzonitriles Aralkylamines Alkyl aryl ethers Pyridines and derivatives N-substituted imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Nitriles Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenylcarbonitrile - Chromane - Benzopyran - 1-benzopyran - Benzonitrile - Alkyl aryl ether - Aralkylamine - N-substituted imidazole - Pyridine - Heteroaromatic compound - Azole - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Organoheterocyclic compound - Secondary amine - Oxacycle - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Azacycle - Carbonitrile - Nitrile - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic 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