Compound Identification
SMILES
BrC1=CC=C(C=C1)C(=O)COC(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O
InChIKey
InChIKey=QDKBAVIHNVOLLI-KBPBESRZSA-N
Formula
C18H16BrNO5
Mass
406.232
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
-
Level 6
Alpha amino acids and derivatives
-
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
Alkyl-phenylketones Indolyl carboxylic acids and derivatives Isoindolones Indoles Isoindoles Aryl alkyl ketones Benzoyl derivatives Bromobenzenes Alpha-acyloxy ketones N-substituted carboxylic acid imides Aryl bromides Pyrrolidine-2-ones N-alkylpyrrolidines Dicarboximides Lactams Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Alkyl-phenylketone - Indolyl carboxylic acid derivative - Isoindolone - Phenylketone - Indole - Isoindoline - Isoindole - Isoindole or derivatives - Benzoyl - Aryl alkyl ketone - Aryl ketone - Bromobenzene - Halobenzene - Alpha-acyloxy ketone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Pyrrolidine - Carboxylic acid imide - Dicarboximide - Ketone - Lactam - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organobromide - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - 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