Compound Identification
SMILES
CC(C)(C)OC(=O)NCCC1=CNC2=C1C=C(CN1CCN(CC3=CC=C(C=C3)[N+]([O-])=O)S1(=O)=O)C=C2
InChIKey
InChIKey=GBMAXWBSSCIRBW-UHFFFAOYSA-N
Formula
C25H31N5O6S
Mass
529.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Nitrobenzenes Nitroaromatic compounds Sulfuric acid diamides Substituted pyrroles Thiadiazolidines Carbamate esters Heteroaromatic compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Organic salts Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Sulfuric acid diamide - Substituted pyrrole - Benzenoid - Organic sulfuric acid or derivatives - Pyrrole - Thiadiazolidine - Carbamic acid ester - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available