Compound Identification
SMILES
COC(=O)C(SC1=CC=CC=C1)(C(C=C)C1=CC=CC=C1)C1=C2CCCCC2=CO1
InChIKey
InChIKey=SJMPMUANTGMDNM-UHFFFAOYSA-N
Formula
C26H26O3S
Mass
418.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Isobenzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isobenzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isobenzofurans
Alternative Parents
Thiophenol ethers Fatty acid esters Alkylarylthioethers Benzene and substituted derivatives Methyl esters Heteroaromatic compounds Furans Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isobenzofuran - Aryl thioether - Thiophenol ether - Fatty acid ester - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Furan - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isobenzofurans. These are organic aromatic compounds containing an isobenzofuran moiety.
External Descriptors
Not available