Compound Identification
SMILES
CC(C)OC(=O)NC(=NC[C@@H](C)C1=C(NC2=C1C=C(C=C2)C(C)(C)C(=O)N1CC2CCC1CC2)C1=CC(C)=CC(C)=C1)N1CCC(C1)C1=CC=NC=C1
InChIKey
InChIKey=YFJGQBUULAZRPO-MTROSTSGSA-N
Formula
C44H56N6O3
Mass
716.971
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 2-phenylindoles
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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
2-phenylindoles
Alternative Parents
Phenylpyrroles 3-alkylindoles N-acylpiperidines m-Xylenes Pyridines and derivatives Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Carbamate esters Guanidines Carboximidamides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylindole - 2-phenylpyrrole - 3-alkylindole - N-acyl-piperidine - M-xylene - Xylene - Substituted pyrrole - Monocyclic benzene moiety - Benzenoid - Pyridine - Piperidine - Pyrrolidine - Tertiary carboxylic acid amide - Carbamic acid ester - Pyrrole - Heteroaromatic compound - Carboxamide group - Guanidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-phenylindoles. These are indoles substituted at the 2-position with a phenyl group.
External Descriptors
Not available