Compound Identification
SMILES
CC(N)=C1C(=O)C=C2OC3=C(C(C)=O)C(O)=C(C)C(O)=C3C2(C)C1=O
InChIKey
InChIKey=SPBCRTZCVHEBTB-UHFFFAOYSA-N
Formula
C18H17NO6
Mass
343.335
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Acetophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Acetophenones
Intermediate Tree Nodes
Not available
Direct Parent
Acetophenones
Alternative Parents
Coumarans O-quinomethanes Aryl alkyl ketones Phenols Cyclohexenones Vinylogous esters Vinylogous amides Vinylogous acids Oxacyclic compounds Enamines Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acetophenone - Coumaran - O-quinomethane - Quinomethane - Aryl alkyl ketone - Aryl ketone - Cyclohexenone - Phenol - Vinylogous ester - Vinylogous amide - Vinylogous acid - Ketone - Cyclic ketone - Enamine - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Primary amine - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acetophenones. These are organic compounds containing the acetophenone structure.
External Descriptors
Not available