4-[4-(3-methylphenyl)phenyl]sulfonyl-3-oxidanyl-oxane-3-carboxylic acid

Systemtic Name: 4-[4-(3-methylphenyl)phenyl]sulfonyl-3-oxidanyl-oxane-3-carboxylic acid Openeye Name: 3-hydroxy-4-[4-(m-tolyl)phenyl]sulfonyl-tetrahydropyran-3-carboxylic acid CAS Name: 3-hydroxy-4-[4-(3-methylphenyl)phenyl]sulfonyl-3-oxanecarboxylic acid IUPAC Name: 3-hydroxy-4-[4-(3-methylphenyl)phenyl]sulfonyloxane-3-carboxylic acid Traditional Name: 3-hydroxy-4-[4-(m-tolyl)phenyl]sulfonyl-tetrahydropyran-3-carboxylic acid Formula: C19H20O6S MolecularWeight: 376.4235

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)C3CCOCC3(C(=O)O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)C3CCOCC3(C(=O)O)O

InChI

InChI=1S/C19H20O6S/c1-13-3-2-4-15(11-13)14-5-7-16(8-6-14)26(23,24)17-9-10-25-12-19(17,22)18(20)21/h2-8,11,17,22H,9-10,12H2,1H3,(H,20,21)