Compound Identification
SMILES
CC1N(CC(=O)O[C@@]1(CN1C=NC=N1)C1=C(Cl)C=C(Cl)C=C1)C(=O)C1=CC=C(OCC(F)(F)C(F)F)C=C1
InChIKey
InChIKey=ZBNYFGJTAOBBFT-NLPMCADVSA-N
Formula
C24H20Cl2F4N4O4
Mass
575.34
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
Phenylmorpholines Benzamides Morpholine carboxylic acids and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Triazoles Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Lactones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organochlorides Organofluorides Alkyl fluorides Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Phenylmorpholine - Benzamide - Benzoic acid or derivatives - Morpholine-4-carboxylic acid or derivatives - Benzoyl - 1,3-dichlorobenzene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Morpholine - Oxazinane - Tertiary carboxylic acid amide - 1,2,4-triazole - Azole - Heteroaromatic compound - Lactone - Carboxylic acid ester - Carboxamide group - Monocarboxylic acid or derivatives - Oxacycle - Ether - Organoheterocyclic compound - Azacycle - Organochloride - Carbonyl group - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organohalogen compound - 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