Compound Identification
SMILES
CC1=CC=C(C=C1)C(\COC1=CC2=C(C=C1)C1=C(CCC1)C(=O)O2)=N/O
InChIKey
InChIKey=FMBXQTZOIBZZIO-QOCHGBHMSA-N
Formula
C21H19NO4
Mass
349.386
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 Toluenes Pyranones and derivatives Alkyl aryl ethers Ketoximes Heteroaromatic compounds Lactones Oxacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Alkyl aryl ether - Pyranone - Toluene - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Ketoxime - Lactone - Ether - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organooxygen compound - 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