Compound Identification
SMILES
CN=C1CCC2=C1N(C)C1=C2C(Br)=C(OC(=O)NCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=YRMPTPZWCQVVTR-UHFFFAOYSA-N
Formula
C21H20BrN3O2
Mass
426.314
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass N-alkylindoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
N-alkylindoles
Intermediate Tree Nodes
Not available
Direct Parent
N-alkylindoles
Alternative Parents
3-alkylindoles N-methylpyrroles Benzene and substituted derivatives Aryl bromides Secondary ketimines Heteroaromatic compounds Carbamate esters Azomethines Organic carbonic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - 3-alkylindole - Indole - Benzenoid - Substituted pyrrole - N-methylpyrrole - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Heteroaromatic compound - Carbamic acid ester - Secondary ketimine - Pyrrole - Azomethine - Carbonic acid derivative - Ketimine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Imine - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 1-position.
External Descriptors
Not available