Compound Identification
SMILES
Cl.OC(=O)C1=C(NCC2=CC(Cl)=C(Cl)C=C2)C=CC(Br)=C1
InChIKey
InChIKey=KMZZSKNQUGGMGZ-UHFFFAOYSA-N
Formula
C14H11BrCl3NO2
Mass
411.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
3-halobenzoic acids Aminobenzoic acids Halobenzoic acids Benzoic acids Phenylalkylamines Aniline and substituted anilines Benzoyl derivatives Benzylamines Dichlorobenzenes Secondary alkylarylamines Bromobenzenes Aryl bromides Aryl chlorides Vinylogous amides Amino acids Carboxylic acids Hydrochlorides Organic oxides Organobromides Organochlorides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - Aminobenzoic acid - Aminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Benzylamine - 1,2-dichlorobenzene - Bromobenzene - Chlorobenzene - Aralkylamine - Halobenzene - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl chloride - Aryl halide - Vinylogous amide - Amino acid - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Amine - Hydrochloride - Hydrocarbon derivative - Organochloride - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available