Compound Identification
SMILES
[Br-].CCOC(=O)CCCN1\C(SC2=CC=CC=C12)=C\C=C\C1=CC=[N+](CCO)C2=CC=CC=C12
InChIKey
InChIKey=DUNLYTRIBRRKAJ-UHFFFAOYSA-M
Formula
C27H29BrN2O3S
Mass
541.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
Benzothiazoles Aryl thioethers Fatty acid esters Pyridinium derivatives Benzenoids Thiazoles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Ketene acetals Carboxylic acid esters Alkanolamines Azacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Carbonyl compounds Hydrocarbon derivatives Organic bromide salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Fatty acid ester - Pyridine - Pyridinium - Benzenoid - Fatty acyl - Thiazole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Ketene acetal or derivatives - Azacycle - Carboxylic acid derivative - Alkanolamine - Monocarboxylic acid or derivatives - Organic salt - Amine - Hydrocarbon derivative - Organic bromide salt - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Alcohol - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available