Compound Identification
SMILES
COC1=CC(OC)=C(NC(=O)[C@@H](CCS(C)(=O)=O)N2CC3=CC=CC=C3C2=O)C=C1
InChIKey
InChIKey=WRVMRHOTZHHIBQ-GOSISDBHSA-N
Formula
C21H24N2O6S
Mass
432.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoindoles and derivatives
-
Subclass
Isoindolines
- Level 5 Isoindolones
-
Subclass
Isoindolines
-
Class
Isoindoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoindolones
Alternative Parents
Alpha amino acids and derivatives Dimethoxybenzenes Methoxyanilines Isoindoles Anilides Phenoxy compounds N-arylamides Anisoles Alkyl aryl ethers Fatty amides Tertiary carboxylic acid amides Sulfones Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Isoindolone - M-dimethoxybenzene - Dimethoxybenzene - Methoxyaniline - Anilide - Isoindole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Sulfonyl - Tertiary carboxylic acid amide - Sulfone - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Ether - Carboxylic acid derivative - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
External Descriptors
Not available