Compound Identification
SMILES
[O-][N+](=O)c1nn(-c2ccc3OCCOc3c2)[n+]([O-])c1Nc1ccc(Cl)cc1
InChIKey
InChIKey=CIPODXDHKDAWJH-UHFFFAOYSA-N
Formula
C16H12ClN5O5
Mass
389.75
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Aniline and substituted anilines Nitroaromatic compounds Alkyl aryl ethers Chlorobenzenes Para dioxins Aryl chlorides Imidolactams Triazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Amines Organochlorides Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Nitroaromatic compound - Aniline or substituted anilines - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Para-dioxin - Benzenoid - Azole - Heteroaromatic compound - 1,2,3-triazole - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Azacycle - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amine - Organic salt - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available