Compound Identification
SMILES
COC1=CC=CC=C1\C=[N+]1/NC(=O)[C@H](NC(=O)C2=CC(C)=CC=C2)[C@H]1C1=CC=C(Cl)C=C1
InChIKey
InChIKey=MYVQODHDBOYLTR-VNGKGULCSA-O
Formula
C25H23ClN3O3
Mass
448.93
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
m-Toluamides Benzamides Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Chlorobenzenes Alkyl aryl ethers Aryl chlorides Pyrazolidinones Shiff bases Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - M-toluamide - Toluamide - Benzoic acid or derivatives - Benzamide - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Chlorobenzene - Halobenzene - Alkyl aryl ether - Toluene - Pyrazolidinone - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Pyrazolidine - Secondary carboxylic acid amide - Carboxamide group - Shiff base - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteromonocyclic 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