Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)COC(=O)[C@H](C)NC1=C(C=C(C=C1)C(F)(F)F)[N+]([O-])=O
InChIKey
InChIKey=CGOVAKXLSBYDFO-NSHDSACASA-N
Formula
C19H17F3N2O6
Mass
426.348
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
-
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
Alkyl-phenylketones Alanine and derivatives Trifluoromethylbenzenes Nitrobenzenes Phenylalkylamines Phenoxy compounds Aniline and substituted anilines Anisoles Nitroaromatic compounds Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Secondary alkylarylamines Alkyl aryl ethers Alpha-acyloxy ketones Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organofluorides Organic salts Organic zwitterions Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid ester - Alanine or derivatives - Trifluoromethylbenzene - Nitrobenzene - Phenylketone - Phenol ether - Aryl ketone - Aryl alkyl ketone - Benzoyl - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Alpha-acyloxy ketone - Benzenoid - Monocyclic benzene moiety - C-nitro compound - Ketone - Carboxylic acid ester - Organic nitro compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic zwitterion - Organohalogen compound - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic 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