Compound Identification
SMILES
CN1C=C(N=CC2=CC=CC=C2[N+]([O-])=O)C(=N1)C(N)=O
InChIKey
InChIKey=SHCSLYZYJFTKOQ-UHFFFAOYSA-N
Formula
C12H11N5O3
Mass
273.252
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
Pyrazole-5-carboxamides Nitroaromatic compounds 2-heteroaryl carboxamides Heteroaromatic compounds Shiff bases Primary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organooxygen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - 2-heteroaryl carboxamide - Nitroaromatic compound - Pyrazole-5-carboxamide - Azole - Pyrazole - Heteroaromatic compound - Carboxamide group - C-nitro compound - Organic nitro compound - Primary carboxylic acid amide - Shiff base - Aldimine - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic salt - Organic zwitterion - Imine - Hydrocarbon derivative - Organic nitrogen compound - 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