Compound Identification
SMILES
COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C1/CCC(C1)C(S)=O
InChIKey
InChIKey=HSLZECDLDMXHQY-ONNFQVAWSA-N
Formula
C18H20O5S
Mass
348.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isocoumarans
-
Subclass
Isobenzofuranones
- Level 5 Phthalides
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Subclass
Isobenzofuranones
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Class
Isocoumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isocoumarans
Subclass
Isobenzofuranones
Intermediate Tree Nodes
Not available
Direct Parent
Phthalides
Alternative Parents
Anisoles Alkyl aryl ethers Vinylogous acids Lactones Carboxylic acid esters Carbothioic S-acids Carbodithioic acids Thiocarboxylic acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Alkylthiols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalide - Anisole - Alkyl aryl ether - Benzenoid - Vinylogous acid - Carbodithioic acid - Carbothioic s-acid - Carboxylic acid ester - Lactone - Alkylthiol - Oxacycle - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.
External Descriptors
Not available