Compound Identification
SMILES
CC(NCC1=CC=C(NCC2=CC=CC=C2Br)C=C1)C(N)=O
InChIKey
InChIKey=HBPMDUOBKHSVHV-UHFFFAOYSA-N
Formula
C17H20BrN3O
Mass
362.271
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
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
Alpha amino acid amides Alanine and derivatives Phenylalkylamines Benzylamines Aniline and substituted anilines Secondary alkylarylamines Bromobenzenes Aryl bromides Primary carboxylic acid amides Dialkylamines Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - Alpha-amino acid amide - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzylamine - Phenylalkylamine - Aniline or substituted anilines - Aralkylamine - Bromobenzene - Secondary aliphatic/aromatic amine - Halobenzene - Aryl bromide - Aryl halide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organobromide - Amine - Organohalogen compound - Organonitrogen compound - Organic oxide - 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