Compound Identification
SMILES
CCOC(=O)N1C[C@@H]2CC[C@H](C1)N2C[C@@H](COC1=CC=C(C=C1)C#N)NC(=O)OC
InChIKey
InChIKey=GEWGADIOFRLYDP-OKZBNKHCSA-N
Formula
C21H28N4O5
Mass
416.478
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
- Subclass Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Piperazine carboxylic acids and derivatives
Direct Parent
Piperazine carboxylic acids
Alternative Parents
Phenoxy compounds Phenol ethers Benzonitriles N-alkylpiperazines Azepanes Alkyl aryl ethers N-alkylpyrrolidines Methylcarbamates Trialkylamines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Piperazine-1-carboxylic acid - Phenoxy compound - Benzonitrile - Phenol ether - Alkyl aryl ether - Azepane - N-alkylpiperazine - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Methylcarbamate - Carbamic acid ester - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Ether - Carbonitrile - Nitrile - Azacycle - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Cyanide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available