Compound Identification
SMILES
CN(C)CCOCC(CC(=O)NC1=NC=C(Cl)C=C1)NC(=O)C1=CC=C(C=C1)N1C=CC=CC1=O
InChIKey
InChIKey=APXVWQIKNFGELQ-UHFFFAOYSA-N
Formula
C25H28ClN5O4
Mass
497.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
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
Benzamides N-arylamides Benzoyl derivatives Pyridinones Dihydropyridines Aryl chlorides Imidolactams Fatty amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Lactams Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Benzoic acid or derivatives - Benzamide - Benzoyl - N-arylamide - Pyridinone - Dihydropyridine - Aryl chloride - Fatty amide - Imidolactam - Benzenoid - Fatty acyl - Hydropyridine - Monocyclic benzene moiety - Aryl halide - Pyridine - Heteroaromatic compound - Tertiary aliphatic amine - Lactam - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Ether - Organoheterocyclic compound - Dialkyl ether - Amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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