Compound Identification
SMILES
[O-][N+](=O)C1=CC(=C(NCCNCCOC2=NON=C2C2=CC=CC=C2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=FNHPKKONZJVYMT-UHFFFAOYSA-N
Formula
C18H18N6O6
Mass
414.378
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Aniline and substituted anilines
- Level 5 Dinitroanilines
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Subclass
Aniline and substituted anilines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Dinitroanilines
Alternative Parents
Nitrobenzenes Phenylalkylamines Nitroaromatic compounds Secondary alkylarylamines Alkyl aryl ethers Furazans Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Oxacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic salts Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dinitroaniline - Nitrobenzene - Nitroaromatic compound - Phenylalkylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Azole - Furazan - Heteroaromatic compound - Oxadiazole - C-nitro compound - Organic nitro compound - Secondary aliphatic amine - Ether - Oxacycle - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dinitroanilines. These are organic compounds containing an aniline moiety, which is substituted at 2 positions by a nitro group.
External Descriptors
Not available