Compound Identification
SMILES
CC1=NC(=CN1CC(Cl)CN1C=C(N=C1C)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=NNJKPNBLEZMCGA-UHFFFAOYSA-N
Formula
C11H13ClN6O4
Mass
328.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Imidazoles
-
Level 5
Substituted imidazoles
- Level 6 Nitroimidazoles
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Level 5
Substituted imidazoles
-
Subclass
Imidazoles
-
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
1,2,4-trisubstituted imidazoles Nitroaromatic compounds Imidolactams N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organopnictogen compounds Organic oxides Organic salts Hydrocarbon derivatives Organochlorides Organonitrogen compounds Alkyl chlorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,2,4-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - N-substituted imidazole - Imidolactam - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organic nitrogen compound - Organohalogen compound - Organic oxide - Organopnictogen compound - Alkyl chloride - Alkyl halide - Organic salt - Organic oxygen compound - 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