Compound Identification
SMILES
CC1(C)C2(C)CCC1(OC2=O)C(=O)NNC=C1C=C(C=CC1=O)[N+]([O-])=O
InChIKey
InChIKey=SRYNOTGZZDPLHJ-UHFFFAOYSA-N
Formula
C17H19N3O6
Mass
361.354
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
Delta valerolactones Gamma butyrolactones Oxanes Pyrans Vinylogous amides Oxolanes C-nitro compounds Carboxylic acid hydrazides Carboxylic acid esters Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Organic salts Organic oxides Hydrocarbon derivatives Aldehydes Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
O-quinomethane - Delta valerolactone - Delta_valerolactone - Gamma butyrolactone - Oxane - Pyran - Oxolane - Vinylogous amide - Organic nitro compound - Carboxylic acid ester - Carboxylic acid hydrazide - Lactone - C-nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Oxacycle - Organic oxoazanium - Monocarboxylic acid or derivatives - Organic salt - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organic cation - Aliphatic heteropolycyclic 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