Compound Identification
SMILES
CN(C)C1=CC=C(C=C1)C1=C(N=C(O1)C1=CC=CC=C1)S(=O)(=O)NCCC(O)=O
InChIKey
InChIKey=MPZHDTFTQOEEBU-UHFFFAOYSA-N
Formula
C20H21N3O5S
Mass
415.46
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 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Phenyl-1,3-oxazoles Dialkylarylamines Aniline and substituted anilines 2,4,5-trisubstituted oxazoles Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Amino acids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,3-oxazole - Beta amino acid or derivatives - 2,4,5-trisubstituted 1,3-oxazole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Organosulfonic acid amide - Monocyclic benzene moiety - Benzenoid - Azole - Sulfonyl - Organic sulfonic acid or derivatives - Oxazole - Organosulfonic acid or derivatives - Heteroaromatic compound - Aminosulfonyl compound - Tertiary amine - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available