Compound Identification
SMILES
CC1=CC=C(NCC(=O)NNC(=C)C2=CC(Br)=CC=C2)C=C1
InChIKey
InChIKey=SJDCOVBHJCJELT-UHFFFAOYSA-N
Formula
C17H18BrN3O
Mass
360.255
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
Styrenes Phenylalkylamines Aniline and substituted anilines Aminotoluenes Secondary alkylarylamines Bromobenzenes Aryl bromides Carboxylic acid hydrazides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Aminotoluene - Phenylalkylamine - Aniline or substituted anilines - Styrene - Bromobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid hydrazide - Secondary amine - Organobromide - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic 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