Compound Identification
SMILES
OC(=O)N1C[C@H]2C(NC(=O)C3=CC4=NNN=C4C=C3)[C@@]2(CC2=CC(Cl)=CC(Cl)=C2)C1
InChIKey
InChIKey=OTBUYBJIAPNPGS-GCTQLOCRSA-N
Formula
C20H17Cl2N5O3
Mass
446.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
-
Subclass
Benzylpiperidines
- Level 5 3-benzylpiperidines
-
Subclass
Benzylpiperidines
-
Class
Piperidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
3-benzylpiperidines
Alternative Parents
Piperidinecarboxylic acids Benzotriazoles Pyrrolidine carboxylic acids Dichlorobenzenes Aryl chlorides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Carbamic acids Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-benzylpiperidine - Benzotriazole - Piperidinecarboxylic acid - 1,3-dichlorobenzene - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - 1,2,3-triazole - Triazole - Pyrrolidine - Carbamic acid derivative - Carbamic acid - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-benzylpiperidines. These are organic compounds containing a benzyl group attached to the 3-position of a piperidine.
External Descriptors
Not available