Compound Identification
SMILES
CC1=NOC(=N1)C1=CN(N=N1)C1CCN(CC1)C(=O)C1=CC(Br)=CC=C1
InChIKey
InChIKey=WDIFEEOKJBKPJD-UHFFFAOYSA-N
Formula
C17H17BrN6O2
Mass
417.267
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
Benzoyl derivatives
- Level 5 1-benzoylpiperidines
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Subclass
Benzoyl derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
1-benzoylpiperidines
Alternative Parents
N-benzoylpiperidines 3-halobenzoic acids and derivatives Benzamides Bromobenzenes Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds 1,2,4-oxadiazoles Triazoles Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzoylpiperidine - 1-benzoylpiperidine - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - N-acyl-piperidine - Benzamide - Benzoic acid or derivatives - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Piperidine - Tertiary carboxylic acid amide - 1,2,4-oxadiazole - Oxadiazole - 1,2,3-triazole - Azole - Heteroaromatic compound - Carboxamide group - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl group.
External Descriptors
Not available