Compound Identification
SMILES
COC(=O)CN1C=NC2=C(C(NC3=C(F)C=C(I)C=C3)=CC(=O)N2C)C1=O
InChIKey
InChIKey=KGIAKEDGDXIUBD-UHFFFAOYSA-N
Formula
C17H14FIN4O4
Mass
484.226
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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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
Pyrido[2,3-d]pyrimidines Aniline and substituted anilines Pyrimidones Pyridinones Aminopyridines and derivatives Iodobenzenes Fluorobenzenes Aryl fluorides Aryl iodides Vinylogous amides Methyl esters Heteroaromatic compounds Lactams Secondary amines Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Pyridopyrimidine - Pyrido[2,3-d]pyrimidine - Aniline or substituted anilines - Iodobenzene - Pyridinone - Aminopyridine - Pyrimidone - Halobenzene - Fluorobenzene - Benzenoid - Pyrimidine - Pyridine - Aryl fluoride - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Vinylogous amide - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Lactam - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Organonitrogen compound - Organooxygen compound - Amine - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organofluoride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organoiodide - 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