Compound Identification
SMILES
CC(C)(C)OC(=O)N1CC2CN(CCCNC3=CC=C(C=C3)C#N)CC(C1)C2O
InChIKey
InChIKey=OKMKFCJXAKMFAI-UHFFFAOYSA-N
Formula
C22H32N4O3
Mass
400.523
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
-
Subclass
Piperidinecarboxylic acids and derivatives
- Level 5 Piperidinecarboxylic acids
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Subclass
Piperidinecarboxylic acids and derivatives
-
Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Piperidinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Piperidinecarboxylic acids
Alternative Parents
Phenylalkylamines Benzonitriles Aniline and substituted anilines Secondary alkylarylamines Carbamate esters Trialkylamines Secondary alcohols Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Piperidinecarboxylic acid - Benzonitrile - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Secondary amine - Azacycle - Cyanide - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid group.
External Descriptors
Not available