Compound Identification
SMILES
NC(CCCC1=CC=C(C=C1)N(CCCl)CCCl)C(O)=O
InChIKey
InChIKey=YSSSVODKUJTKAF-UHFFFAOYSA-N
Formula
C15H22Cl2N2O2
Mass
333.25
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
Alpha amino acids Aniline and substituted anilines Dialkylarylamines Nitrogen mustard compounds Medium-chain fatty acids Aralkylamines Halogenated fatty acids Amino acids Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organopnictogen compounds Organic oxides Carbonyl compounds Alkyl chlorides Organochlorides Monoalkylamines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbutylamine - Alpha-amino acid - Alpha-amino acid or derivatives - Nitrogen mustard - Aniline or substituted anilines - Dialkylarylamine - Medium-chain fatty acid - Tertiary aliphatic/aromatic amine - Halogenated fatty acid - Aralkylamine - Fatty acyl - Fatty acid - Amino acid or derivatives - Amino acid - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Primary aliphatic amine - Organic oxide - Alkyl halide - Alkyl chloride - Carbonyl group - Organopnictogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic homomonocyclic 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