Compound Identification
SMILES
CCOC(=O)C1CCCCN1c1c(cc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O
InChIKey
InChIKey=JEWYFHFNUMUIME-UHFFFAOYSA-N
Formula
C15H16F3N3O6
Mass
391.303
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
-
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
Dinitroanilines Phenylpiperidines Trifluoromethylbenzenes Piperidinecarboxylic acids Nitrobenzenes Dialkylarylamines Nitroaromatic compounds Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Alkyl fluorides Hydrocarbon derivatives Organic oxides Organic salts Organofluorides Carbonyl compounds Organopnictogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Dinitroaniline - Phenylpiperidine - Trifluoromethylbenzene - Nitrobenzene - Piperidinecarboxylic acid - Aniline or substituted anilines - Dialkylarylamine - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Piperidine - Benzenoid - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Tertiary amine - Azacycle - Monocarboxylic acid or derivatives - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organohalogen compound - Alkyl fluoride - Organic oxygen compound - Organic oxide - Organopnictogen compound - Amine - Alkyl halide - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic cation - Aromatic heteromonocyclic 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