Compound Identification
SMILES
COCC(=O)N(CC1=CC2=C(OCO2)C=C1)C1CC(=CC(OC2=CC=CC=C2I)C1O)C(=O)NCCO
InChIKey
InChIKey=AJEMWRLUXGPSGZ-UHFFFAOYSA-N
Formula
C26H29IN2O8
Mass
624.428
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
Phenoxy compounds Phenol ethers N-acylethanolamines Alkyl aryl ethers Iodobenzenes Aryl iodides Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary alcohols Acetals Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organopnictogen compounds Organoiodides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Phenoxy compound - N-acylethanolamine - Phenol ether - Alkyl aryl ether - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Alkanolamine - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Acetal - Primary alcohol - Alcohol - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organoiodide - 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