Compound Identification
SMILES
CC1=CC(=O)OC2=CC(C)=C(NC3=NC4=CC=CC=C4O3)C=C12
InChIKey
InChIKey=YMOQVPJQMRKWDF-UHFFFAOYSA-N
Formula
C18H14N2O3
Mass
306.321
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 Benzoxazoles Pyranones and derivatives Benzenoids Oxazoles Heteroaromatic compounds Lactones Secondary amines Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Benzoxazole - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Oxazole - Azole - Lactone - Organoheterocyclic compound - Secondary amine - Azacycle - Oxacycle - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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