Compound Identification
SMILES
COC1=CC=CC(=C1)N1C(=O)N(C2CCCCC2)C2(CCN(CC3=CC=C(C=C3)C3=CC=CC(=C3)C#N)CC2)C1=O
InChIKey
InChIKey=YFVVMTOTCLZMMV-UHFFFAOYSA-N
Formula
C34H36N4O3
Mass
548.687
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
Phenylhydantoins N-benzylpiperidines Phenylimidazolidines Alpha amino acids and derivatives Azaspirodecane derivatives Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Phenylmethylamines Benzylamines Benzonitriles N-acyl ureas Alkyl aryl ethers Aralkylamines Dicarboximides Trialkylamines Nitriles Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenylcarbonitrile - N-benzylpiperidine - Benzylpiperidine - 3-phenylhydantoin - Hydantoin - Phenylimidazolidine - Alpha-amino acid or derivatives - Azaspirodecane - Methoxyaniline - Phenoxy compound - Phenol ether - Anisole - Phenylmethylamine - Benzonitrile - Methoxybenzene - Benzylamine - Alkyl aryl ether - N-acyl urea - Ureide - Aralkylamine - Piperidine - Imidazolidinone - Imidazolidine - Dicarboximide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Urea - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Nitrile - Carbonitrile - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organonitrogen compound - Organopnictogen compound - Organic oxide - 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