Compound Identification
SMILES
CC(N1C(=O)C2C(C3C=CC2C2CC32)C1=O)C(=O)NC1=C(C)C=C(Br)C(C)=C1
InChIKey
InChIKey=XAJRWMRGRYGNSD-UHFFFAOYSA-N
Formula
C22H23BrN2O3
Mass
443.341
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 Alanine and derivatives
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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
Alanine and derivatives
Alternative Parents
Isoindolones Anilides p-Xylenes N-arylamides Bromobenzenes Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alanine or derivatives - Isoindolone - Isoindoline - Isoindole or derivatives - Anilide - P-xylene - Xylene - N-arylamide - Bromobenzene - Halobenzene - Benzenoid - N-alkylpyrrolidine - Aryl halide - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Aryl bromide - Carboxylic acid imide, n-substituted - Pyrrolidine - Carboxylic acid imide - Dicarboximide - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available