Compound Identification
SMILES
CN1C2=C(N(CC(=O)OCC3=C(Cl)C=C(Cl)C=C3)C=N2)C(=O)N(C)C1=O
InChIKey
InChIKey=UPBUGPVMJYMFAK-UHFFFAOYSA-N
Formula
C16H14Cl2N4O4
Mass
397.21
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 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
Xanthines 6-oxopurines Benzyloxycarbonyls Alkaloids and derivatives Dichlorobenzenes Pyrimidones Aryl chlorides N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Ureas Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Xanthine - 6-oxopurine - Purinone - Benzyloxycarbonyl - Imidazopyrimidine - Purine - Alkaloid or derivatives - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Pyrimidone - Pyrimidine - N-substituted imidazole - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Urea - Carboxylic acid ester - Lactam - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic 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