Compound Identification
SMILES
COC1=NC(Cl)=CC(=C1)C(=O)N1CCC2(CCN(C2)C(=O)C(CC(C)=C)NC(C)=O)CC1
InChIKey
InChIKey=XLTUISKIDCQWEB-UHFFFAOYSA-N
Formula
C23H31ClN4O4
Mass
462.98
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- 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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Azaspirodecane derivatives Pyridinecarboxylic acids and derivatives N-acylpiperidines N-acylpyrrolidines 2-halopyridines Alkyl aryl ethers Aryl chlorides Tertiary carboxylic acid amides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Azaspirodecane - N-acyl-piperidine - Pyridine carboxylic acid or derivatives - N-acylpyrrolidine - Alkyl aryl ether - 2-halopyridine - Aryl chloride - Aryl halide - Piperidine - Pyridine - Heteroaromatic compound - Acetamide - Pyrrolidine - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available