Compound Identification
SMILES
[O-]C(=O)\C=C/C([O-])=O.[O-][N+](=O)C1=CC=CC=CS1
InChIKey
InChIKey=KAKLIYJIMIYOAP-BTJKTKAUSA-L
Formula
C10H7NO6S
Mass
269.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiepins
Alternative Parents
Unsaturated fatty acids Dicarboxylic acids and derivatives Thioenol ethers Ketene acetals Carboxylic acid salts C-nitro compounds Organic oxoazanium compounds Carboxylic acids Organonitrogen compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Not available
Substituents
Thiepin - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acid - Fatty acyl - Carboxylic acid salt - Organic nitro compound - Ketene acetal or derivatives - Thioenolether - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic cation - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiepins. These are heterocyclic compounds containing an unsaturated seven-member heterocycle, with six carbon atoms and one sulfur atom.
External Descriptors
Not available