Compound Identification
SMILES
O=C(COC1=CC=CC=C1)NNC(=O)C1=CSC(=N1)C1CCN(CC1)C(=O)OCC#C
InChIKey
InChIKey=ZKKWFPSSJKKABD-UHFFFAOYSA-N
Formula
C21H22N4O5S
Mass
442.49
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
Thiazolecarboxamides Phenoxy compounds Phenol ethers 2,4-disubstituted thiazoles Alkyl aryl ethers Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Carboxylic acid hydrazides Acetylides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperidinecarboxylic acid - Phenoxy compound - Phenol ether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Carbamic acid ester - Thiazole - Carboxylic acid hydrazide - Carbonic acid derivative - Ether - Carboxylic acid derivative - Acetylide - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - 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