Compound Identification
SMILES
[Gd].COCCOCCOC1=CC=C\C(=C\NCCN(CCN\C=C2\C=CC=C(OCCOCCOC)C2=O)CCN\C=C2\C=CC=C(OCCOCCOC)C2=O)C1=O
InChIKey
InChIKey=CNTMHGGOZSKDIF-RPFZBHJMSA-N
Formula
C42H60GdN4O12
Mass
970.21
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
Vinylogous amides Trialkylamines Enamines Dialkylamines Dialkyl ethers Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
O-quinomethane - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Secondary aliphatic amine - Enamine - Ether - Secondary amine - Allylamine - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Amine - Hydrocarbon derivative - Aliphatic 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