Compound Identification
SMILES
CC1=CC=CC=C1C1=CC(CCCC1)NCC1=CN=CN1CC1=CC=C(Br)C=C1
InChIKey
InChIKey=NMUOGQRJKHWMOF-UHFFFAOYSA-N
Formula
C25H28BrN3
Mass
450.424
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Bromobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Bromobenzenes
Alternative Parents
Toluenes Aralkylamines N-substituted imidazoles Aryl bromides Heteroaromatic compounds Dialkylamines Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Bromobenzene - Toluene - Aralkylamine - Aryl halide - Aryl bromide - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Organoheterocyclic compound - Secondary aliphatic amine - Azacycle - Secondary amine - Organobromide - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
External Descriptors
Not available