Compound Identification
SMILES
COC(=O)[C@H](CC1=CC(=C(OC)C=C1)[N+]([O-])=O)NC(=O)C1=CC=CC=C1C(F)(F)F
InChIKey
InChIKey=DDODZFQFHQJPRR-AWEZNQCLSA-N
Formula
C19H17F3N2O6
Mass
426.348
Taxonomic Classification
Taxonomy Tree
-
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 Phenylalanine and derivatives
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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
Phenylalanine and derivatives
Alternative Parents
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid esters Nitrophenyl ethers Trifluoromethylbenzenes Amphetamines and derivatives Methoxyanilines Methoxybenzenes Phenoxy compounds Nitroaromatic compounds Benzoyl derivatives Anisoles Fatty acid esters Alkyl aryl ethers Methyl esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid ester - Nitrophenyl ether - Trifluoromethylbenzene - Amphetamine or derivatives - Nitrobenzene - Benzoic acid or derivatives - Methoxyaniline - Benzamide - Phenol ether - Benzoyl - Phenoxy compound - Methoxybenzene - Anisole - Nitroaromatic compound - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Methyl ester - Organic nitro compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Alkyl halide - Alkyl fluoride - Carbonyl group - Organonitrogen compound - Organofluoride - Organic salt - Organic nitrogen compound - Organohalogen compound - Organooxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available