Compound Identification
SMILES
COC(=O)NC1=C(N2CC2)C(=O)C(NC(=O)OC)=C(N2CC2)C1=O
InChIKey
InChIKey=TXIHYKAQJWLHOP-UHFFFAOYSA-N
Formula
C14H16N4O6
Mass
336.304
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
Quinones
-
Level 8
Benzoquinones
- Level 9 P-benzoquinones
-
Level 8
Benzoquinones
-
Level 7
Quinones
-
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 - Quinones - Benzoquinones
Direct Parent
P-benzoquinones
Alternative Parents
Vinylogous amides N-vinylaziridines Methylcarbamates Trialkylamines Organic carbonic acids and derivatives Enamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
P-benzoquinone - Methylcarbamate - N-vinylaziridine - Vinylaziridine - Vinylogous amide - Carbamic acid ester - Carbonic acid derivative - Tertiary aliphatic amine - Tertiary amine - Aziridine - Enamine - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 4-positions, respectively.
External Descriptors
Not available