Compound Identification
SMILES
NC(CNC1=C(C=C(Br)C=C1)C(O)=O)CC1=CC=CC=C1Cl
InChIKey
InChIKey=SCUCKPVJWXMJEL-UHFFFAOYSA-N
Formula
C16H16BrClN2O2
Mass
383.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenethylamines
- Level 5 Amphetamines and 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
Amphetamines and derivatives
Alternative Parents
3-halobenzoic acids Aminobenzoic acids Halobenzoic acids Benzoic acids Phenylalkylamines Aniline and substituted anilines Benzoyl derivatives Secondary alkylarylamines Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Vinylogous amides Amino acids Carboxylic acids Monoalkylamines Organic oxides Organobromides Organochlorides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid - Aminobenzoic acid or derivatives - Amphetamine or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzoic acid - Aniline or substituted anilines - Phenylalkylamine - Benzoyl - Aralkylamine - Bromobenzene - Secondary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Vinylogous amide - Amino acid or derivatives - Amino acid - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Primary amine - Organooxygen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organochloride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors
Not available