Compound Identification
SMILES
ClCCN1N=NC2=C(N=CN2C1=O)C(=O)ON1C(=O)CCC1=O
InChIKey
InChIKey=JJWUXISHFJMKNR-UHFFFAOYSA-N
Formula
C11H9ClN6O5
Mass
340.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Imidazotetrazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazotetrazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Imidazotetrazines
Alternative Parents
Carbonylimidazoles Tetrazines Pyrrolidine-2-ones N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Dicarboximides Lactams Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Imidazotetrazine - Imidazole-4-carbonyl group - Tetrazine - 2-pyrrolidone - Pyrrolidone - N-substituted imidazole - Azole - Dicarboximide - Imidazole - Heteroaromatic compound - Vinylogous amide - Pyrrolidine - Lactam - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Alkyl chloride - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazotetrazines. These are organic polycyclic compounds containing an imidazole ring fused to a tetrazine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Tetrazine is a six-membered aromatic heterocycle made up of four nitrogen atoms and a two carbon atoms.
External Descriptors
Not available