Compound Identification
SMILES
NCCC1=CNC2=C1C=C(OC(=O)C1=CC=CC=C1C(=O)OCC1=CC=CC=C1)C=C2
InChIKey
InChIKey=ODMPHEXPFJLGJT-UHFFFAOYSA-N
Formula
C25H22N2O4
Mass
414.461
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Tryptamines and derivatives
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Tryptamines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tryptamines and derivatives
Alternative Parents
Phenol esters 3-alkylindoles Benzyloxycarbonyls Benzoic acid esters 2-arylethylamines Benzoyl derivatives Aralkylamines Substituted pyrroles Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tryptamine - Benzoate ester - Benzyloxycarbonyl - Phenol ester - 3-alkylindole - Benzoic acid or derivatives - Indole - 2-arylethylamine - Benzoyl - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
External Descriptors
Not available