Compound Identification
SMILES
CC1=CC(=CC(Br)=C1)N1NC=C2C1C(=O)NC2=O
InChIKey
InChIKey=TYULAHFPGAOXPF-UHFFFAOYSA-N
Formula
C12H10BrN3O2
Mass
308.135
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
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Pyrrolopyrazoles Toluenes Bromobenzenes Aryl bromides Pyrrolidine-2-ones Vinylogous amides Pyrazolines Dicarboximides N-unsubstituted carboxylic acid imides Lactams Azacyclic compounds Alkylhydrazines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrrolopyrazole - Bromobenzene - Halobenzene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrazoline - Pyrrolidine - Vinylogous amide - Lactam - Azacycle - Alkylhydrazine - Organoheterocyclic compound - Organobromide - Organohalogen compound - Organic oxygen compound - Hydrazine derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available