Compound Identification
SMILES
NC(N)=NCCNC1=NC(=O)N(CC2=CC=C(F)C=C2)C(=O)N1CC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=SWSGLVRGFZXJIT-UHFFFAOYSA-N
Formula
C20H21FN8O4
Mass
456.438
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
Nitroaromatic compounds Triazinones Secondary alkylarylamines Fluorobenzenes N-aliphatic s-triazines 1,3,5-triazines Aryl fluorides Heteroaromatic compounds Ureas Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboximidamides Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Amino-1,3,5-triazine - Aminotriazine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Triazinone - N-aliphatic s-triazine - Aryl fluoride - Aryl halide - 1,3,5-triazine - Triazine - Heteroaromatic compound - Guanidine - Organic nitro compound - C-nitro compound - Urea - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Carboximidamide - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic salt - Organooxygen compound - Organohalogen compound - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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