Compound Identification
SMILES
Cl.COC1=C(NC=C1)\C=C1/C(=O)NC2=C1C(C#CC1(O)CCNCC1)=C(F)C=C2
InChIKey
InChIKey=JKALXAFOMHEIHG-CTMPBGLUSA-N
Formula
C21H21ClFN3O3
Mass
417.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indolines
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolines
Intermediate Tree Nodes
Not available
Direct Parent
Indolines
Alternative Parents
Alkyl aryl ethers Ynones Aryl fluorides Benzenoids Piperidines Substituted pyrroles Heteroaromatic compounds Tertiary alcohols Lactams Secondary carboxylic acid amides Amino acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dihydroindole - Alkyl aryl ether - Aryl fluoride - Aryl halide - Piperidine - Benzenoid - Ynone - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Tertiary alcohol - Amino acid or derivatives - Carboxamide group - Lactam - Secondary carboxylic acid amide - Secondary amine - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Alcohol - Hydrocarbon derivative - Amine - Organohalogen compound - Organofluoride - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Hydrochloride - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolines. These are compounds containing an indole moiety, which consists of pyrrolidine ring fused to benzene to form 2,3-dihydroindole.
External Descriptors
Not available