Compound Identification
SMILES
CC1=CC(Br)=CC(Cl)=C1OC(=O)CN1C(=O)C2=CC=CC=C2C1=O
InChIKey
InChIKey=IKQRLLLRVMVCHA-UHFFFAOYSA-N
Formula
C17H11BrClNO4
Mass
408.63
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
Indolyl carboxylic acids and derivatives Phthalimides Phenol esters Indoles Isoindoles Phenoxy compounds Toluenes Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides N-substituted carboxylic acid imides Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organonitrogen compounds Carbonyl compounds Organobromides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indolyl carboxylic acid derivative - Phthalimide - Isoindolone - Phenol ester - Isoindole or derivatives - Isoindole - Isoindoline - Indole - Phenoxy compound - Bromobenzene - Halobenzene - Chlorobenzene - Toluene - Aryl bromide - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Aryl halide - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen 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