Compound Identification
SMILES
CCOC(=O)C(C(C[N+]([O-])=O)C1=CC2=C(OCO2)C=C1)C(=O)CCCC(C)C
InChIKey
InChIKey=XMKXPRDJUIHXHT-UHFFFAOYSA-N
Formula
C20H27NO7
Mass
393.436
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Beta-keto acids and derivatives Fatty acid esters 1,3-dicarbonyl compounds Benzenoids C-nitro compounds Carboxylic acid esters Ketones Monocarboxylic acids and derivatives Acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Aldehydes Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Beta-keto acid - Fatty acid ester - 1,3-dicarbonyl compound - Fatty acyl - Keto acid - Benzenoid - C-nitro compound - Ketone - Carboxylic acid ester - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Acetal - Organic nitrogen compound - Aldehyde - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available