Compound Identification
SMILES
O[C@@H](CNC(=O)[C@H]1CCCN(C1)C(=O)C1=CC=CS1)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=VLVIIHPCWGDAIB-HOCLYGCPSA-N
Formula
C19H21N3O5S
Mass
403.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
- Subclass N-acylpiperidines
-
Class
Piperidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
N-acylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-acylpiperidines
Alternative Parents
Nitrobenzenes Piperidinecarboxamides Thiophene carboxamides 2-heteroaryl carboxamides Nitroaromatic compounds Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Secondary carboxylic acid amides Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Aromatic alcohols Carbonyl compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-piperidine - Nitrobenzene - 3-piperidinecarboxamide - Piperidinecarboxamide - 2-heteroaryl carboxamide - Nitroaromatic compound - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Tertiary amine - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Amine - Organic salt - Organic nitrogen compound - Aromatic alcohol - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acylpiperidines. These are compounds containing an N-acyethanolamine moiety, which is characterized by an acyl group is linked to the nitrogen atom of a piperidine.
External Descriptors
Not available