Compound Identification
SMILES
[O-][N+](=O)C1=C(C=CC(=C1)N1CCB(CC1)OC#N)C#N
InChIKey
InChIKey=ZFETUEIISOWKNS-UHFFFAOYSA-N
Formula
C12H11BN4O3
Mass
270.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Aniline and substituted anilines Benzonitriles Dialkylarylamines Nitroaromatic compounds Azaborinanes Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Cyanates Organic metalloid salts Nitriles Dialkylboranes Hydrocarbon derivatives Organic oxides Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Benzonitrile - Dialkylarylamine - Aniline or substituted anilines - 1,4-azaborinane - C-nitro compound - Tertiary amine - Organic nitro compound - Organic cyanate - Carbonitrile - Nitrile - Dialkylborane - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic metalloid salt - Azacycle - Organooxygen compound - Organonitrogen compound - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organic salt - Alkylborane - Organic oxide - Hydrocarbon derivative - Organic metalloid moeity - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available