Compound Identification
SMILES
Cl.COCC(=O)N(C)C1=CC=C(\C=C\C(=O)NCC(=O)N(C)C2=C(Cl)C(COC3=CC=CN4C(Br)=C(C)N=C34)=C(Cl)C=C2)C=C1
InChIKey
InChIKey=NPSBGZOFXUVNAX-KYIGKLDSSA-N
Formula
C31H31BrCl3N5O5
Mass
739.87
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
Cinnamic acid amides Alpha amino acid amides Imidazo[1,2-a]pyridines Anilides Imidazopyridines Styrenes Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Pyridines and derivatives Aryl bromides N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Cinnamic acid amide - Cinnamic acid or derivatives - Imidazo[1,2-a]pyridine - Anilide - Imidazopyridine - 1,3-dichlorobenzene - Styrene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Pyridine - Tertiary carboxylic acid amide - Azole - Imidazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Ether - Azacycle - Dialkyl ether - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Hydrochloride - Carbonyl group - Organic nitrogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen 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