5-[4-(2-carboxyphenyl)-2-methylsulfonyl-phenyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[4-(2-carboxyphenyl)-2-methylsulfonyl-phenyl]thiophene-2-carboxylic acid Openeye Name: 5-[4-(2-carboxyphenyl)-2-methylsulfonyl-phenyl]thiophene-2-carboxylic acid CAS Name: 5-[4-(2-carboxyphenyl)-2-methylsulfonylphenyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[4-(2-carboxyphenyl)-2-methylsulfonylphenyl]thiophene-2-carboxylic acid Traditional Name: 5-[4-(2-carboxyphenyl)-2-mesyl-phenyl]-2-thenoic acid Formula: C19H14O6S2 MolecularWeight: 402.44086

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)C3=CC=C(S3)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C19H14O6S2/c1-27(24,25)17-10-11(12-4-2-3-5-13(12)18(20)21)6-7-14(17)15-8-9-16(26-15)19(22)23/h2-10H,1H3,(H,20,21)(H,22,23)