Compound Identification
SMILES
CC(C)C(CCCN1CCN(CCO)CC1)(C#N)C1=CC=CC=C1C
InChIKey
InChIKey=VKGACIOKUYATIR-UHFFFAOYSA-N
Formula
C21H33N3O
Mass
343.515
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Phenylpropanes Toluenes N-alkylpiperazines Aralkylamines Trialkylamines 1,2-aminoalcohols Nitriles Azacyclic compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Phenylpropane - Aralkylamine - N-alkylpiperazine - Toluene - 1,4-diazinane - Piperazine - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Alkanolamine - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Amine - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available