Compound Identification
SMILES
CC1=C(C=CC=C1[N+]([O-])=O)C(=O)NCCN1C(=O)S\C(=C/C2=CC=C(F)C=C2)C1=O
InChIKey
InChIKey=GVFGWOGCYXFKRO-BOPFTXTBSA-N
Formula
C20H16FN3O5S
Mass
429.42
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
o-Toluamides Benzamides Nitrotoluenes Nitroaromatic compounds Benzoyl derivatives Thiazolidinediones Fluorobenzenes Aryl fluorides Dicarboximides Thiocarbamic acid derivatives Tertiary amines Secondary carboxylic acid amides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - O-toluamide - Toluamide - Benzamide - Benzoic acid or derivatives - Nitrotoluene - Nitroaromatic compound - Benzoyl - Thiazolidinedione - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Aryl halide - Thiazolidine - Dicarboximide - C-nitro compound - Thiocarbamic acid derivative - Carboxamide group - Organic nitro compound - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organooxygen compound - Organohalogen compound - Amine - Organofluoride - Organonitrogen 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