Compound Identification
SMILES
COC1=NC(C)=C(C)N=C1N(C)C(=O)N1CCN(CC1)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=RXHXJTJTAWXBEB-UHFFFAOYSA-N
Formula
C19H23N7O6
Mass
445.436
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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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
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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
Phenylpiperazines N-arylpiperazines Piperazine carboxamides Nitrobenzenes Dialkylarylamines Methoxypyrazines Nitroaromatic compounds Alkyl aryl ethers Imidolactams Heteroaromatic compounds Ureas Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organic salts Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dinitroaniline - Phenylpiperazine - N-arylpiperazine - Nitrobenzene - Piperazine-1-carboxamide - Nitroaromatic compound - Methoxypyrazine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - 1,4-diazinane - Piperazine - Imidolactam - Pyrazine - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Tertiary amine - Urea - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Ether - Azacycle - Organic oxoazanium - Organic salt - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - Organic oxygen compound - Organic cation - 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