Compound Identification
SMILES
CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)OC(C#N)C1=CC(OC)=C(OC)C=C1[N+]([O-])=O)C(=O)O2
InChIKey
InChIKey=LHLMYXKKHFSURC-UHFFFAOYSA-N
Formula
C24H23N3O8
Mass
481.461
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 1-benzopyrans Benzyloxycarbonyls Dimethoxybenzenes Methoxyanilines Phenoxy compounds Anisoles Dialkylarylamines Nitroaromatic compounds Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Lactones Organic oxoazanium compounds Oxacyclic compounds Nitriles Propargyl-type 1,3-dipolar organic compounds Organic oxides Organic salts Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Coumarin - 1-benzopyran - Dimethoxybenzene - O-dimethoxybenzene - Benzopyran - Benzyloxycarbonyl - Methoxyaniline - Nitrobenzene - Tertiary aliphatic/aromatic amine - Phenol ether - Dialkylarylamine - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Pyranone - Alkyl aryl ether - Pyran - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Lactone - C-nitro compound - Organic nitro compound - Tertiary amine - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Carboxylic acid derivative - Nitrile - Carbonitrile - Oxacycle - Ether - Organic zwitterion - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organonitrogen compound - Cyanide - Organooxygen 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