4-(4-chloranylphenoxy)-2-(phenylsulfonylmethyl)oxane-4-carboxylic acid

Systemtic Name: 4-(4-chloranylphenoxy)-2-(phenylsulfonylmethyl)oxane-4-carboxylic acid Openeye Name: 2-(benzenesulfonylmethyl)-4-(4-chlorophenoxy)tetrahydropyran-4-carboxylic acid CAS Name: 2-(benzenesulfonylmethyl)-4-(4-chlorophenoxy)-4-oxanecarboxylic acid IUPAC Name: 2-(benzenesulfonylmethyl)-4-(4-chlorophenoxy)oxane-4-carboxylic acid Traditional Name: 2-(besylmethyl)-4-(4-chlorophenoxy)tetrahydropyran-4-carboxylic acid Formula: C19H19ClO6S MolecularWeight: 410.86856

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CC1(C(=O)O)OC2=CC=C(C=C2)Cl)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1COC(CC1(C(=O)O)OC2=CC=C(C=C2)Cl)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19ClO6S/c20-14-6-8-15(9-7-14)26-19(18(21)22)10-11-25-16(12-19)13-27(23,24)17-4-2-1-3-5-17/h1-9,16H,10-13H2,(H,21,22)