Compound Identification
SMILES
CC(N1C(=O)C2=CC=CC=C2C1=O)C(=O)OCC1=NC(=NO1)C1=CC=C(C)C=C1
InChIKey
InChIKey=XIVHWVSMLFVDJJ-UHFFFAOYSA-N
Formula
C21H17N3O5
Mass
391.383
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
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
Indolyl carboxylic acids and derivatives Alanine and derivatives Phthalimides Phenyloxadiazoles Indoles Isoindoles Toluenes N-substituted carboxylic acid imides Heteroaromatic compounds Tertiary amines Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indolyl carboxylic acid derivative - Alanine or derivatives - Phenyl-1,2,4-oxadiazole - Phthalimide - Isoindolone - Isoindole or derivatives - Indole - Isoindoline - Isoindole - Toluene - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-substituted - Heteroaromatic compound - Carboxylic acid imide - Oxadiazole - 1,2,4-oxadiazole - Azole - Carboxylic acid ester - Tertiary amine - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organonitrogen 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