Compound Identification
SMILES
FC(F)(F)C1CC(N=C2N1NC(C(=O)NCC[NH+]1CCOCC1)=C2Cl)C1=CC=C(Br)C=C1
InChIKey
InChIKey=VDSADHLDAHPNNP-UHFFFAOYSA-O
Formula
C20H23BrClF3N5O2
Mass
537.79
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
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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
Pyrazolopyrimidines Bromobenzenes Hydropyrimidines Imidolactams Morpholines Aryl bromides Pyrazolines Pyrazoles Vinylogous halides Quaternary ammonium salts Amidrazones Secondary carboxylic acid amides Trialkylamines Oxacyclic compounds Amidines Chloroalkenes Azacyclic compounds Dialkyl ethers Vinyl chlorides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organochlorides Organofluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrazolopyrimidine - Bromobenzene - Halobenzene - Pyrimidine - Hydropyrimidine - Aryl halide - Benzenoid - Morpholine - Aryl bromide - 1,4,5,6-tetrahydropyrimidine - Monocyclic benzene moiety - Oxazinane - Imidolactam - Pyrazoline - Pyrazole - Vinylogous halide - Quaternary ammonium salt - Carboxylic acid amidrazone - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Organoheterocyclic compound - Haloalkene - Chloroalkene - Amidine - Dialkyl ether - Vinyl halide - Vinyl chloride - Oxacycle - Azacycle - Ether - Alkyl fluoride - Alkyl halide - Organohalogen compound - Organobromide - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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