Compound Identification
SMILES
[Ca++].[O-]CNC(=O)NS(=O)(=O)C1=CC=C(NC(=O)C2=CC=CC=C2C([O-])=O)C=C1
InChIKey
InChIKey=MPSSWSPZVSQBNX-UHFFFAOYSA-M
Formula
C16H13CaN3O7S
Mass
431.43
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Anilides
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Level 5
Aromatic anilides
- Level 6 Benzanilides
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Level 5
Aromatic anilides
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Subclass
Anilides
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Aromatic anilides
Direct Parent
Benzanilides
Alternative Parents
Benzenesulfonamides Benzamides Benzenesulfonyl compounds Benzoic acids Benzoyl derivatives Sulfonylureas Aminosulfonyl compounds Organosulfonic acids and derivatives Secondary carboxylic acid amides Carboxylic acid salts Carboxylic acids Organic calcium salts Hydrocarbon derivatives Organic oxides Carbonyl compounds Alkoxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzanilide - Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzoic acid - Benzenesulfonyl group - Benzoyl - Sulfonylurea - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Organic calcium salt - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic salt - Alkoxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
External Descriptors
Not available