Compound Identification
SMILES
CN1C[C@H]2C3=NN(C)N=C3[C@@]3(CN(C)C[C@@H]3[C@]2(C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=SYNOBWFDTQXPPL-ZFWZSOMGSA-N
Formula
C13H19N7O4
Mass
337.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoindoles and derivatives
- Subclass Isoindolines
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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
Isoindolines
Alternative Parents
Aralkylamines N-alkylpyrrolidines Triazoles Heteroaromatic compounds Trialkylamines C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindoline - Aralkylamine - N-alkylpyrrolidine - Azole - Heteroaromatic compound - Pyrrolidine - 1,2,3-triazole - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Amine - Organic nitrogen compound - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindolines. These are heterocyclic compounds containing a 2,3-dihydro-1H-iso-indole moiety.
External Descriptors
Not available