Compound Identification
SMILES
COC1=CC=C(N2N=C(N=C12)C1(CC1)C(=O)NCC1=CC=CC=C1)C1=CC2=C(C=C1)C(=O)OC2
InChIKey
InChIKey=LQZCDWYAHMANTE-UHFFFAOYSA-N
Formula
C26H22N4O4
Mass
454.486
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isocoumarans
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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
Triazolopyridines Alkyl aryl ethers Pyridines and derivatives Benzene and substituted derivatives Cyclopropanecarboxylic acids and derivatives Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Lactones Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalide - Triazolopyridine - Alkyl aryl ether - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Pyridine - Azole - Heteroaromatic compound - 1,2,4-triazole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactone - Carboxylic acid derivative - Oxacycle - Azacycle - Ether - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen 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