Compound Identification
SMILES
O[Cl](=O)(=O)=O.CCN(CC)CCN1N=C(CC2=C1CCCC2=O)C1=CC=CC=C1
InChIKey
InChIKey=MVWVSOUPMLUROD-UHFFFAOYSA-N
Formula
C20H28ClN3O5
Mass
425.91
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 Cyclohexenones
-
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
Direct Parent
Cyclohexenones
Alternative Parents
Organic perchlorates Benzene and substituted derivatives Vinylogous amides Trialkylamines Hydrazones Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclohexenone - Monocyclic benzene moiety - Organic perchlorate - Benzenoid - Vinylogous amide - Organic chlorate - Tertiary amine - Tertiary aliphatic amine - Hydrazone - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.
External Descriptors
Not available