Compound Identification
SMILES
NC1=C(SC(NC2=CC=C(C=C2)C(O)=O)=N1)C(=O)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=QLRVHAYRHSFQML-UHFFFAOYSA-N
Formula
C17H12N4O5S
Mass
384.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Benzoic acids Nitrobenzenes 2,4,5-trisubstituted thiazoles Aniline and substituted anilines Benzoyl derivatives Nitroaromatic compounds 2-amino-1,3-thiazoles Imidolactams Vinylogous amides Heteroaromatic compounds Amino acids Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Secondary amines Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Primary amines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Benzoic acid or derivatives - Benzoic acid - Nitrobenzene - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Benzoyl - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Imidolactam - 1,3-thiazolamine - 1,3-thiazol-2-amine - Vinylogous amide - Azole - Heteroaromatic compound - Thiazole - Organic nitro compound - Amino acid - Amino acid or derivatives - C-nitro compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid - Organic salt - Amine - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Primary amine - Organic zwitterion - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available