Compound Identification
SMILES
CN1CCC[C@@H]1CC1=CNC2=C1C=C(NC1=C(C=C(C)C=C1)[N+]([O-])=O)C=C2
InChIKey
InChIKey=LYKAWISNNSGZQA-QGZVFWFLSA-N
Formula
C21H24N4O2
Mass
364.449
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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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
Nitrotoluenes Nitrobenzenes Aminotoluenes Aniline and substituted anilines Nitroaromatic compounds Aralkylamines Substituted pyrroles Primary aromatic amines N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Aminotoluene - Aniline or substituted anilines - Toluene - Aralkylamine - Monocyclic benzene moiety - Primary aromatic amine - Substituted pyrrole - N-alkylpyrrolidine - Benzenoid - Pyrrole - Pyrrolidine - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Azacycle - Amine - Organopnictogen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - 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