Compound Identification
SMILES
COC(=O)C1=CC(NC(=O)COC2=CC(C)=C(C)C=C2)=C(C=C1)N1CC[NH+](CC2=CC=CC=C2)CC1
InChIKey
InChIKey=FLDYRIHFWPBOIJ-UHFFFAOYSA-O
Formula
C29H34N3O4
Mass
488.607
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
N-arylpiperazines Phenylpiperazines Benzoic acid esters 2'-Aminoanilides Aminobenzoic acids and derivatives Benzylamines Dialkylarylamines Benzoyl derivatives Phenylmethylamines Phenoxy compounds Phenol ethers Aniline and substituted anilines N-arylamides o-Xylenes Alkyl aryl ethers Aralkylamines N-alkylpiperazines Quaternary ammonium salts Methyl esters Secondary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Phenylpiperazine - N-arylpiperazine - Benzoate ester - Aminobenzoic acid or derivatives - 2'-aminoanilide - Anilide - Phenylmethylamine - N-arylamide - Phenoxy compound - Phenol ether - Dialkylarylamine - Aniline or substituted anilines - O-xylene - Xylene - Benzoyl - Benzylamine - Aralkylamine - N-alkylpiperazine - Alkyl aryl ether - Piperazine - 1,4-diazinane - Quaternary ammonium salt - Methyl ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic heteromonocyclic 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