Compound Identification
SMILES
CCOCCOC(=O)C1OC2=C(OC1C(=O)OCCOCC)C=C(CCNCC(O)C1=CC(Cl)=CC=C1)C=C2
InChIKey
InChIKey=AKLPCDAQHUIEKX-UHFFFAOYSA-N
Formula
C28H36ClNO9
Mass
566.04
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
Phenethylamines Alkyl aryl ethers Chlorobenzenes Aralkylamines Para dioxins Dicarboxylic acids and derivatives Aryl chlorides Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Oxacyclic compounds Dialkylamines Dialkyl ethers Aromatic alcohols Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Phenethylamine - Alkyl aryl ether - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Para-dioxin - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Secondary alcohol - Oxacycle - Ether - Secondary amine - Secondary aliphatic amine - Dialkyl ether - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Aromatic alcohol - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - 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