Compound Identification
SMILES
CC(=O)NC1=CC(Cl)=C(OC(CCC2=CC=C(Cl)C=C2)CN2C=CN=C2)C(Cl)=C1
InChIKey
InChIKey=HONAVTUEDZEIQA-UHFFFAOYSA-N
Formula
C21H20Cl3N3O2
Mass
452.76
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
M-haloacetanilides N-acetylarylamines Phenoxy compounds Phenol ethers Dichlorobenzenes Alkyl aryl ethers N-substituted imidazoles Aryl chlorides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
M-haloacetanilide - Haloacetanilide - Phenylbutylamine - Acetanilide - N-acetylarylamine - Anilide - Phenoxy compound - 1,3-dichlorobenzene - N-arylamide - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - N-substituted imidazole - Azole - Heteroaromatic compound - Acetamide - Imidazole - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - 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