Compound Identification
SMILES
COC1=CC(OC)=CC(CN2C(=O)NC(NC(=O)C3=CC(OC)=C(OC)C=C3)(C2=O)C(F)(F)F)=C1
InChIKey
InChIKey=CNQXEVWWXBIZKZ-UHFFFAOYSA-N
Formula
C22H22F3N3O7
Mass
497.427
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
Hydantoins Dimethoxybenzenes Benzamides Phenoxy compounds Benzoyl derivatives Anisoles N-acyl ureas Alkyl aryl ethers Dicarboximides Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hydantoin - Dimethoxybenzene - O-dimethoxybenzene - M-dimethoxybenzene - Benzoic acid or derivatives - Benzamide - Benzoyl - Methoxybenzene - Phenoxy compound - Phenol ether - Anisole - N-acyl urea - Alkyl aryl ether - Ureide - Imidazolidinone - Benzenoid - Monocyclic benzene moiety - Dicarboximide - Imidazolidine - Carboxamide group - Urea - Secondary carboxylic acid amide - Carbonic acid derivative - Ether - Organoheterocyclic compound - Azacycle - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organohalogen compound - 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