Compound Identification
SMILES
O=[Mo]=O.OCCNC=C1C=CC=CC1=O.OCC[NH+]=CC1=CC=CC=C1[O-]
InChIKey
InChIKey=DVQHSERZWUFGCC-UHFFFAOYSA-N
Formula
C18H22MoN2O6
Mass
458.33
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
Phenoxides Vinylogous amides Shiff bases 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Primary aldimines Organic transition metal salts Enamines Dialkylamines Allylamines Primary alcohols Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
O-quinomethane - Phenoxide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - 1,2-aminoalcohol - Shiff base - Aldimine - Alkanolamine - Secondary aliphatic amine - Enamine - Allylamine - Primary aldimine - Organic transition metal salt - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Primary alcohol - Organic oxide - Organic zwitterion - Organic salt - Organic nitrogen compound - Alcohol - Aromatic homomonocyclic 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