Compound Identification
SMILES
CC1=CC2=C(OC(=O)C(C=O)=C2NC2=CC=CC=C2)C=C1
InChIKey
InChIKey=GJOZCVRWYNGTSF-UHFFFAOYSA-N
Formula
C17H13NO3
Mass
279.295
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Aniline and substituted anilines Pyranones and derivatives Aryl-aldehydes Primary aromatic amines Vinylogous amides Heteroaromatic compounds Lactones Secondary amines Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Aniline or substituted anilines - Pyranone - Aryl-aldehyde - Monocyclic benzene moiety - Primary aromatic amine - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous amide - Lactone - Organoheterocyclic compound - Oxacycle - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aldehyde - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available