Compound Identification
SMILES
CCCCCCCCCCCCOC(=O)C1=CC(NC(=O)C(SC2=CC=CC=C2NC(=O)CCOC2=CC=C(N\N=C3\C(=O)C4=C(NC(C)=O)C=C(C=C4C=C3SOOO)S(O)(=O)=O)C=C2)C(=O)C2=CC=CC=C2C)=C(Cl)C=C1
InChIKey
InChIKey=PBNZNLJDVLTUAS-YXQUTJCXSA-N
Formula
C56H60ClN5O14S3
Mass
1158.75
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
Alkyl-phenylketones 4-halobenzoic acids and derivatives Benzoic acid esters Naphthalenes 1-sulfo,2-unsubstituted aromatic compounds Anilides N-acetylarylamines Thiophenol ethers Aryl alkyl ketones Benzoyl derivatives Phenylhydrazines Phenol ethers Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Toluenes Chlorobenzenes 1,3-dicarbonyl compounds Aryl chlorides Fatty amides Vinylogous amides Sulfonyls Acetamides Organosulfonic acids Secondary carboxylic acid amides Carboxylic acid esters Sulfenyl compounds Hydrazones Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Alkyl-phenylketone - Acylaminobenzoic acid or derivatives - Naphthalene - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - 1-sulfo,2-unsubstituted aromatic compound - Anilide - Arylsulfonic acid or derivatives - Phenylketone - N-acetylarylamine - Phenol ether - Thiophenol ether - Phenylhydrazine - Phenoxy compound - Aryl thioether - N-arylamide - Aryl ketone - Aryl alkyl ketone - Benzoyl - Chlorobenzene - Toluene - Halobenzene - Alkylarylthioether - Alkyl aryl ether - Aryl halide - 1,3-dicarbonyl compound - Fatty amide - Fatty acyl - Aryl chloride - Acetamide - Vinylogous amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Sulfenyl compound - Ether - Thioether - Hydrazone - Organic oxide - Organochloride - Organohalogen compound - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxygen compound - Organooxygen compound - Aromatic homopolycyclic 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