Compound Identification
SMILES
[O-][N+](=O)C1=CC(=C(C=C1)N1CCOC2=C(C3=CC=CC=C3C=C2)C2=C(OCCN(CCOC3=C(C4=CC=CC=C4C=C3)C3=C(OCC1)C=CC1=CC=CC=C31)C1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C=CC1=CC=CC=C21)[N+]([O-])=O
InChIKey
InChIKey=STOYTYOZTKXBJL-UHFFFAOYSA-N
Formula
C60H46N6O12
Mass
1043.058
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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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
Naphthalenes Nitrobenzenes Nitroaromatic compounds Dialkylarylamines Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dinitroaniline - Naphthalene - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - C-nitro compound - Tertiary amine - Organic nitro compound - Ether - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Amine - Organic cation - Aromatic heteropolycyclic 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