Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)N(C([O-])=O)C1=CC2=C(C=C1)C(C)=CC(=O)O2
InChIKey
InChIKey=RDMYCKUQMFONIY-UHFFFAOYSA-M
Formula
C19H16NO6
Mass
354.339
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
Phenylcarbamic acids 1-benzopyrans Dimethoxybenzenes Methoxyanilines Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Tertiary amines Lactones Carbamic acids Oxacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - Phenylcarbamic acid - M-dimethoxybenzene - Dimethoxybenzene - 1-benzopyran - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Tertiary amine - Carbamic acid - Carbamic acid derivative - Lactone - Organoheterocyclic compound - Oxacycle - Ether - Organic oxygen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic anion - 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