Compound Identification
SMILES
COCCN1C(SC2=C1C=CC(Br)=C2)=NC(=O)C1COC2=CC=CC=C2O1
InChIKey
InChIKey=BTQNEPZNXORRPY-UHFFFAOYSA-N
Formula
C19H17BrN2O4S
Mass
449.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
-
Class
Benzodioxanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Benzothiazoles Alkyl aryl ethers Para dioxins Aryl bromides Benzenoids Thiazoles Heteroaromatic compounds N-acylimines Isothioureas Oxacyclic compounds Azacyclic compounds Dialkyl ethers Carboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - 1,3-benzothiazole - Alkyl aryl ether - Aryl halide - Benzenoid - Para-dioxin - Aryl bromide - Azole - Heteroaromatic compound - Thiazole - N-acylimine - Isothiourea - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available