Compound Identification
SMILES
COC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(O)=C1C=CC=C1
InChIKey
InChIKey=CDKZLLSYDSZAMI-UHFFFAOYSA-N
Formula
C20H24Cl2N2O3
Mass
411.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
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
-
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
Alpha amino acid esters Amphetamines and derivatives Nitrogen mustard compounds Dialkylarylamines Aniline and substituted anilines Fatty acid esters Methyl esters Ketene acetals Monocarboxylic acids and derivatives Alkanolamines Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Amphetamine or derivatives - Nitrogen mustard - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Methyl ester - Tertiary amine - Carboxylic acid ester - Ketene acetal or derivatives - Alkanolamine - Monocarboxylic acid or derivatives - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organochloride - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organooxygen compound - Alkyl chloride - 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