Compound Identification
SMILES
CN1C(=O)N(C)C2=C(C=C(C=C2)S(=O)(=O)NC2=CC(=CC(=C2)C(O)=O)C(O)=O)C1=O
InChIKey
InChIKey=GWEWBNCJANBPIC-UHFFFAOYSA-N
Formula
C18H15N3O8S
Mass
433.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Phthalic acid and derivatives
- Level 6 M-phthalic acid and derivatives
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Level 5
Phthalic acid 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
Phthalic acid and derivatives
Direct Parent
M-phthalic acid and derivatives
Alternative Parents
Sulfanilides Quinazolines Benzoic acids Benzoyl derivatives Pyrimidones Organosulfonamides Dicarboxylic acids and derivatives Vinylogous amides Aminosulfonyl compounds Heteroaromatic compounds Ureas Lactams Azacyclic compounds Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Meta_phthalic_acid - Diazanaphthalene - Quinazoline - Sulfanilide - Benzoic acid - Benzoyl - Pyrimidone - Dicarboxylic acid or derivatives - Pyrimidine - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Sulfonyl - Aminosulfonyl compound - Lactam - Urea - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as m-phthalic acid and derivatives. These are aromatic compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 2.
External Descriptors
Not available