Compound Identification
SMILES
CC1=C(C=C(C#N)C#N)C=CC(CCNCCOC(=O)CCCCCCCC(=O)OCCNCCC2=CC(C)=C(C=C(C#N)C#N)C=C2)=C1
InChIKey
InChIKey=RFRCSYKHVMKOMP-UHFFFAOYSA-N
Formula
C39H46N6O4
Mass
662.835
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenethylamines
Alternative Parents
Toluenes Fatty acid esters Aralkylamines Dicarboxylic acids and derivatives Carboxylic acid esters Amino acids and derivatives Nitriles Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenethylamine - Fatty acid ester - Toluene - Aralkylamine - Dicarboxylic acid or derivatives - Fatty acyl - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Nitrile - Carbonitrile - Secondary aliphatic amine - Carboxylic acid derivative - Cyanide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
External Descriptors
Not available