Compound Identification
SMILES
CC(OC(=O)C1CSC2(CCC(=O)N12)C1=CC=C(F)C=C1)C(=O)NC(N)=O
InChIKey
InChIKey=IOCYOFONXPNKGX-UHFFFAOYSA-N
Formula
C17H18FN3O5S
Mass
395.41
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
Phenylpyrrolidines Fluorobenzenes N-acyl ureas Aryl fluorides Pyrrolidine-2-ones N-alkylpyrrolidines Thiazolidines Dicarboximides Tertiary carboxylic acid amides Pyrroles Carboxylic acid esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - 2-phenylpyrrolidine - Fluorobenzene - Halobenzene - N-acyl urea - Ureide - Monocyclic benzene moiety - Aryl fluoride - Benzenoid - N-alkylpyrrolidine - Aryl halide - Pyrrolidone - 2-pyrrolidone - Dicarboximide - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Thiazolidine - Urea - Carboxamide group - Carboxylic acid ester - Carbonic acid derivative - Lactam - Organoheterocyclic compound - Azacycle - Thioether - Dialkylthioether - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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