Compound Identification
SMILES
CCOC(=O)C[C@H]1N2OC[C@H]([C@H]2C2=C(NC1=O)C=CC(Cl)=C2)C(=O)OC
InChIKey
InChIKey=FTGRYUWMJUCUSM-UXIGCNINSA-N
Formula
C17H19ClN2O6
Mass
382.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Alpha amino acids and derivatives Dicarboxylic acids and derivatives Benzenoids Aryl chlorides Methyl esters Isoxazolidines Secondary carboxylic acid amides Lactams Oxacyclic compounds N-organohydroxylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Benzenoid - Isoxazolidine - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Oxacycle - Azacycle - N-organohydroxylamine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available