Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.CCCC1=C(C(C2=CNNC2=N1)C1=CC2=C(OCCO2)C=C1)C(=O)OCC
InChIKey
InChIKey=MMXZABLGLOETNR-WLHGVMLRSA-N
Formula
C24H27N3O8
Mass
485.493
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Alkyl aryl ethers Unsaturated fatty acids Benzenoids Para dioxins Dicarboxylic acids and derivatives Imidolactams Pyrazolines Enoate esters Amidrazones Amidines Oxacyclic compounds Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Benzo-1,4-dioxane - Alkyl aryl ether - Dicarboxylic acid or derivatives - Para-dioxin - Unsaturated fatty acid - Benzenoid - Imidolactam - Fatty acid - Fatty acyl - Pyrazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid amidrazone - Oxacycle - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Ether - Amidine - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available