Compound Identification
SMILES
[Na+].[O-]C(=O)C1=CC=CC(=C1)C1=C(C=CS1)C1=C(OCC2=CC=CC=C2)C=CC(Cl)=C1
InChIKey
InChIKey=RSZDRUAHTFATCN-UHFFFAOYSA-M
Formula
C24H16ClNaO3S
Mass
442.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
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Subclass
Benzoic acids and derivatives
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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
Not available
Direct Parent
Benzoic acids
Alternative Parents
Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Thiophenes Heteroaromatic compounds Carboxylic acid salts Organic metal halides Carboxylic acids Organochlorides Hydrocarbon derivatives Organic oxides Organic sodium salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Heteroaromatic compound - Thiophene - Carboxylic acid salt - Organic metal halide - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic oxygen compound - Organic salt - Organohalogen compound - Organochloride - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available