Compound Identification
SMILES
C[C@H](SC1=NN=C(C[NH+]2CCCCC2)N1CC1=CC=CC=C1)C(=O)NC1=CC(=C(F)C=C1)[N+]([O-])=O
InChIKey
InChIKey=ZEVKIAWJMAGUPC-KRWDZBQOSA-O
Formula
C24H28FN6O3S
Mass
499.58
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
Anilides Nitroaromatic compounds N-arylamides Alkylarylthioethers Aralkylamines Fluorobenzenes Piperidines Aryl fluorides Triazoles Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Sulfenyl compounds Organic oxoazanium compounds Azacyclic compounds Organofluorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Anilide - Aryl thioether - Nitroaromatic compound - N-arylamide - Fluorobenzene - Halobenzene - Aralkylamine - Alkylarylthioether - Aryl fluoride - Aryl halide - Piperidine - Azole - Heteroaromatic compound - Quaternary ammonium salt - 1,2,4-triazole - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Tertiary aliphatic amine - Sulfenyl compound - Organoheterocyclic compound - Thioether - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic salt - Organic oxide - Organofluoride - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Amine - Carbonyl group - Organic oxygen compound - Organosulfur compound - 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