Compound Identification
SMILES
CC1=CC(C)=C(NC(=O)CSC2=NN=C(O2)C2=CC=CC=C2F)C(=C1)[N+]([O-])=O
InChIKey
InChIKey=VDNIOCDJWBOLEJ-UHFFFAOYSA-N
Formula
C18H15FN4O4S
Mass
402.4
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 Nitrotoluenes m-Xylenes Nitroaromatic compounds N-arylamides Alkylarylthioethers Fluorobenzenes Aryl fluorides 1,3,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Anilide - Nitrotoluene - N-arylamide - Aryl thioether - Nitroaromatic compound - Xylene - M-xylene - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl fluoride - Aryl halide - Heteroaromatic compound - Oxadiazole - Azole - 1,3,4-oxadiazole - C-nitro compound - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic 1,3-dipolar compound - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic zwitterion - Organic oxide - Organic salt - 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