Compound Identification
SMILES
CC(=O)NNC(=S)N\C=C(\C(C)=O)C(=O)NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=XJMPYXIRXRSTAV-GHXNOFRVSA-N
Formula
C14H15N5O5S
Mass
365.36
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 N-arylamides Nitroaromatic compounds Alpha-branched alpha,beta-unsaturated ketones Fatty amides Acetamides Acryloyl compounds Vinylogous amides Thiosemicarbazides Enones Ketones Secondary carboxylic acid amides Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organosulfur compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Anilide - Nitroaromatic compound - N-arylamide - Fatty amide - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Acryloyl-group - Enone - Thiosemicarbazide - Alpha,beta-unsaturated ketone - Vinylogous amide - Acetamide - Carboxylic acid hydrazide - Organic nitro compound - Carboxamide group - Ketone - C-nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organic oxide - Organic zwitterion - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aromatic homomonocyclic 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