Compound Identification
SMILES
C1NCC2=CC=CC=C12.CCOC(=O)C1=C(C)NC(C)=C(C1C1=C(C=CC(Cl)=C1)[N+]([O-])=O)C(=O)OC
InChIKey
InChIKey=WWIPXAXGTLSGCQ-UHFFFAOYSA-N
Formula
C26H28ClN3O6
Mass
513.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoindoles and derivatives
- Subclass Isoindoles
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Class
Isoindoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindoles
Intermediate Tree Nodes
Not available
Direct Parent
Isoindoles
Alternative Parents
Dihydropyridinecarboxylic acids and derivatives Nitrobenzenes Isoindolines Nitroaromatic compounds Aralkylamines Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Vinylogous amides Enoate esters Methyl esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Enamines Organochlorides Carbonyl compounds Organic oxides Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Nitrobenzene - Isoindole - Isoindoline - Dihydropyridinecarboxylic acid derivative - Nitroaromatic compound - Halobenzene - Dihydropyridine - Aralkylamine - Chlorobenzene - Dicarboxylic acid or derivatives - Aryl chloride - Benzenoid - Hydropyridine - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Vinylogous amide - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Azacycle - Secondary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Enamine - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole.
External Descriptors
Not available