Compound Identification
SMILES
CN1NC(=N\C1=C1\C=C(C=CC1=O)[N+]([O-])=O)C1=C(C)C=CC=N1
InChIKey
InChIKey=FFKJTRTZFPLYHQ-RVDMUPIBSA-N
Formula
C15H13N5O3
Mass
311.301
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 O-quinomethanes
-
Level 7
Quinomethanes
-
Level 6
Cyclic 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 - Cyclic ketones - Quinomethanes
Direct Parent
O-quinomethanes
Alternative Parents
Methylpyridines Imidolactams Heteroaromatic compounds Vinylogous amides Triazolines Ketene acetals Amidrazones C-nitro compounds Organic oxoazanium compounds Azacyclic compounds Amidines Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Methylpyridine - Pyridine - Imidolactam - Triazoline - Heteroaromatic compound - Vinylogous amide - Carboxylic acid amidrazone - Ketene acetal or derivatives - C-nitro compound - Organic nitro compound - Amidine - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available