Compound Identification
SMILES
CC1=C(C)C2=C(OC1=O)C=C(OCC1=CC(=NO1)C1(C)CC1)C=C2
InChIKey
InChIKey=XYEUOLBJDYCKMI-UHFFFAOYSA-N
Formula
C19H19NO4
Mass
325.364
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 Phenol ethers 3-cyclopropylisoxazoles Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Lactones Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - 3-cyclopropylisoxazole - Cyclopropylisoxazole - Phenol ether - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Azole - Isoxazole - Heteroaromatic compound - Lactone - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen 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