Compound Identification
SMILES
NC1=NON=C1N1N=NC(C(=O)NNC=C2C=CC=CC2=O)=C1CN1CCCC1
InChIKey
InChIKey=CRUXFELSTFGKKS-UHFFFAOYSA-N
Formula
C17H19N9O3
Mass
397.399
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
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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
Aralkylamines N-alkylpyrrolidines Imidolactams Vinylogous amides Triazoles Heteroaromatic compounds Furazans Trialkylamines Carboxylic acid hydrazides Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Aralkylamine - N-alkylpyrrolidine - Imidolactam - Azole - Furazan - Oxadiazole - Pyrrolidine - 1,2,3-triazole - Vinylogous amide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid hydrazide - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Amine - Primary amine - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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