Compound Identification
SMILES
O=C(N1CC[NH+](CC1)[C@@H]1CCS(=O)(=O)C1)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=VWTTUTRBUYZERB-CQSZACIVSA-O
Formula
C17H21N2O4S
Mass
349.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
2-heteroaryl carboxamides Furoic acid and derivatives N-alkylpiperazines Benzenoids Thiolanes Tertiary carboxylic acid amides Heteroaromatic compounds Sulfones Quaternary ammonium salts Trialkylamines Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - 2-heteroaryl carboxamide - Furoic acid or derivatives - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Furan - Quaternary ammonium salt - Sulfone - Tertiary carboxylic acid amide - Thiolane - Heteroaromatic compound - Carboxamide group - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Oxacycle - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available