Compound Identification
SMILES
CC(=O)C1=C(C)N=C(C)C=C1NCC1=CC=C(Br)C=C1
InChIKey
InChIKey=VVLDZAOFLUCDQS-UHFFFAOYSA-N
Formula
C16H17BrN2O
Mass
333.229
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Phenylmethylamines
Alternative Parents
Benzylamines Aryl alkyl ketones Secondary alkylarylamines Methylpyridines Bromobenzenes Aralkylamines Aminopyridines and derivatives Aryl bromides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Phenylmethylamine - Aryl ketone - Aryl alkyl ketone - Aminopyridine - Bromobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Methylpyridine - Aralkylamine - Aryl halide - Aryl bromide - Pyridine - Heteroaromatic compound - Vinylogous amide - Ketone - Secondary amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available