Compound Identification
SMILES
CCOC(=O)C1=CC=C(NC(=O)C23CCC(CC2)(CC3)NCC(=O)N2C[C@@H](F)C[C@H]2C#N)C=C1
InChIKey
InChIKey=NGFNSMNBPBPPTB-QYQPWLLASA-N
Formula
C25H31FN4O4
Mass
470.545
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Alpha amino acid amides Benzoic acid esters Anilides N-arylamides N-acylpyrrolidines Benzoyl derivatives Tertiary carboxylic acid amides Tertiary amines Secondary carboxylic acid amides Carboxylic acid esters Nitriles Azacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzoate ester - Anilide - N-acylpyrrolidine - Benzoyl - N-arylamide - Pyrrolidine - Tertiary carboxylic acid amide - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Carbonitrile - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Nitrile - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available