Compound Identification
SMILES
CCOC(=O)[C@@H](OS(C)(=O)=O)[C@H]1O[C@H](C2=CC=CC=C2Cl)C2=C(C=CC(Cl)=C2)N(C(C)C)C1=O
InChIKey
InChIKey=KOYJBSMZDKOABJ-NJYVYQBISA-N
Formula
C23H25Cl2NO7S
Mass
530.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Chlorobenzenes Aryl chlorides Organosulfonic acid esters Sulfonic acid esters Methanesulfonates Tertiary carboxylic acid amides Sulfonyls Lactams Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Sulfonic acid ester - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Carboxamide group - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Dialkyl ether - Azacycle - Ether - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).
External Descriptors
Not available