Compound Identification
SMILES
CS(=O)(=O)NCCCC1=NC(NC2=CC=CC(=C2)C(O)=O)=NC(NC2=CC=CC(=C2)C(O)=O)=N1
InChIKey
InChIKey=OIZWQQZTLFXVFV-UHFFFAOYSA-N
Formula
C21H22N6O6S
Mass
486.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Aminobenzoic acids and derivatives
- Level 6 Aminobenzoic acids
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Level 5
Aminobenzoic acids and derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Aminobenzoic acids and derivatives
Direct Parent
Aminobenzoic acids
Alternative Parents
Benzoic acids 1,3,5-triazine-2,4-diamines Aniline and substituted anilines Benzoyl derivatives 1,3,5-triazines Organosulfonamides Organic sulfonamides Aminosulfonyl compounds Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Secondary amines Organooxygen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminobenzoic acid - Benzoic acid - 2,4-diamine-s-triazine - Aniline or substituted anilines - Benzoyl - Amino-1,3,5-triazine - Aminotriazine - Organic sulfonic acid amide - Organosulfonic acid amide - Triazine - 1,3,5-triazine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Amino acid - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
External Descriptors
Not available