Compound Identification
SMILES
COC(=O)C1=C(OC(=N1)[C@@H](N)C(C)C)C1=CNC2=C1C=CC=C2Br
InChIKey
InChIKey=OYPWNQMXZVOJFJ-LBPRGKRZSA-N
Formula
C17H18BrN3O3
Mass
392.253
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- 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
Indoles
Alternative Parents
2,4,5-trisubstituted oxazoles Aralkylamines Substituted pyrroles Benzenoids Aryl bromides Methyl esters Heteroaromatic compounds Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organobromides Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - 2,4,5-trisubstituted 1,3-oxazole - Aralkylamine - Aryl bromide - Aryl halide - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Azole - Methyl ester - Pyrrole - Oxazole - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Azacycle - Organohalogen compound - Primary aliphatic amine - Primary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available