Compound Identification
SMILES
COC(=O)CN1C(C2=CC=CC=C2)C2=C(NC1(O)C1=CC=CC=C1)C=CC(Br)=C2
InChIKey
InChIKey=HXSJLWRKXXNZLF-UHFFFAOYSA-N
Formula
C23H21BrN2O3
Mass
453.336
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Quinazolines Benzene and substituted derivatives Aryl bromides Methyl esters Orthocarboxylic acid derivatives Monocarboxylic acids and derivatives Azacyclic compounds Alkanolamines Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Quinazoline - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Methyl ester - Orthocarboxylic acid derivative - Carboxylic acid ester - Alkanolamine - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available