Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C(C1C1=[N+](C)C(=CN1)[N+]([O-])=O)C(=O)OCCCO[N+](O)=O
InChIKey
InChIKey=SIDDSZMVHIAFJR-UHFFFAOYSA-P
Formula
C18H25N5O9
Mass
455.423
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Nitroimidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Nitroimidazoles
Alternative Parents
1,2,5-trisubstituted imidazoles Nitroaromatic compounds Dihydropyridines Dicarboxylic acids and derivatives N-substituted imidazoles Vinylogous amides Alkyl nitrates Enoate esters Heteroaromatic compounds Amino acids and derivatives Organic nitric acids and derivatives Enamines Organic oxoazanium compounds Dialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - Dihydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - N-substituted imidazole - Heteroaromatic compound - Organic nitrate - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Alkyl nitrate - Organic nitro compound - Amino acid or derivatives - Organic nitric acid or derivatives - Carboxylic acid ester - C-nitro compound - Secondary amine - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Secondary aliphatic amine - Enamine - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group.
External Descriptors
Not available