Compound Identification
SMILES
COC1=C(OC)C=C2C(COC3=CC=C(C=C3)[N+]([O-])=O)N(CCC2=C1)C(=O)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=PYOAWJGYZJCTCQ-UHFFFAOYSA-N
Formula
C28H24N2O8
Mass
516.506
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
Nitrophenyl ethers Tetrahydroisoquinolines 1-benzopyrans Phenoxy compounds Anisoles Nitroaromatic compounds Pyranones and derivatives Alkyl aryl ethers Tertiary carboxylic acid amides Heteroaromatic compounds Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Coumarin - 1-benzopyran - Tetrahydroisoquinoline - Benzopyran - Nitrobenzene - Phenoxy compound - Phenol ether - Nitroaromatic compound - Anisole - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Lactone - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Oxacycle - Ether - Organic salt - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic cation - 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