Compound Identification
SMILES
COC(=O)C1=CC=C(CN2C(=O)SC(=CC3=CC4=C(OCO4)C=C3C)C2=O)O1
InChIKey
InChIKey=SCISQACRSMEVPK-UHFFFAOYSA-N
Formula
C19H15NO7S
Mass
401.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Furoic acid esters Thiazolidinediones Benzenoids Dicarboximides Heteroaromatic compounds Methyl esters Thiocarbamic acid derivatives Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Acetals Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furoic acid ester - Benzodioxole - Furoic acid or derivatives - Thiazolidinedione - Benzenoid - Dicarboximide - Furan - Thiazolidine - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Thiocarbamic acid derivative - Monocarboxylic acid or derivatives - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available