Compound Identification
SMILES
CCOC(=O)[C@H]1CCCN(C1)C(=O)CSC1=NN=C(COC2=C(C)C=CC(C)=C2)O1
InChIKey
InChIKey=ZNNCDULQIASMJR-INIZCTEOSA-N
Formula
C21H27N3O5S
Mass
433.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
-
Subclass
Piperidinecarboxylic acids and derivatives
- Level 5 Piperidinecarboxylic acids
-
Subclass
Piperidinecarboxylic acids and derivatives
-
Class
Piperidines
-
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
N-acylpiperidines p-Xylenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Alkylarylthioethers Tertiary carboxylic acid amides 1,3,4-oxadiazoles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Carboxylic acid esters Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperidinecarboxylic acid - N-acyl-piperidine - Phenol ether - Phenoxy compound - Aryl thioether - P-xylene - Xylene - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Oxadiazole - Azole - Tertiary carboxylic acid amide - 1,3,4-oxadiazole - Carboxylic acid ester - Tertiary amine - Amino acid or derivatives - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Ether - Monocarboxylic acid or derivatives - Thioether - Amine - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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