Compound Identification
SMILES
CCOC(=O)CN1C(SC2=C1C=CC(=C2)S(N)(=O)=O)=NC(=O)C1=CC=CC=C1I
InChIKey
InChIKey=FZLRQBAQPWFXJS-UHFFFAOYSA-N
Formula
C18H16IN3O5S2
Mass
545.37
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
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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
2-halobenzoic acids and derivatives Benzothiazoles Benzoyl derivatives Iodobenzenes Organosulfonamides Aryl iodides Vinylogous halides Heteroaromatic compounds Thiazoles Aminosulfonyl compounds Isothioureas Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 1,3-benzothiazole - Benzoic acid or derivatives - Benzoyl - Halobenzene - Iodobenzene - Monocyclic benzene moiety - Organosulfonic acid amide - Aryl halide - Aryl iodide - Benzenoid - Thiazole - Sulfonyl - Azole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Aminosulfonyl compound - Vinylogous halide - Isothiourea - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organoiodide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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