Compound Identification
SMILES
CC(C)(C)OC(=O)N1[C@@H](Br)[C@@H]1CN1C=C(C#N)C2=CC=CC=C12
InChIKey
InChIKey=YNBGUAUKFFDJFN-ZOMUKPOZSA-N
Formula
C17H18BrN3O2
Mass
376.254
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
Indoles Substituted pyrroles Benzenoids Aziridinecarboxylic acids Heteroaromatic compounds Carbamate esters Nitriles Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - Indole - Aziridinecarboxylic acid - Substituted pyrrole - Benzenoid - Pyrrole - Carbamic acid ester - Heteroaromatic compound - Azacycle - Aziridine - Carbonitrile - Nitrile - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alkyl bromide - Cyanide - Alkyl halide - Organic oxide - 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