4-[(2,4-dichlorophenyl)methoxy]-3-oxidanyl-2-oxidanylidene-4-(phenylsulfonyl)oxane-3-carboxylic acid

Systemtic Name: 4-[(2,4-dichlorophenyl)methoxy]-3-oxidanyl-2-oxidanylidene-4-(phenylsulfonyl)oxane-3-carboxylic acid Openeye Name: 4-(benzenesulfonyl)-4-[(2,4-dichlorophenyl)methoxy]-3-hydroxy-2-oxo-tetrahydropyran-3-carboxylic acid CAS Name: 4-(benzenesulfonyl)-4-[(2,4-dichlorophenyl)methoxy]-3-hydroxy-2-oxo-3-oxanecarboxylic acid IUPAC Name: 4-(benzenesulfonyl)-4-[(2,4-dichlorophenyl)methoxy]-3-hydroxy-2-oxooxane-3-carboxylic acid Traditional Name: 4-besyl-4-(2,4-dichlorobenzyl)oxy-3-hydroxy-2-keto-tetrahydropyran-3-carboxylic acid Formula: C19H16Cl2O8S MolecularWeight: 475.29654

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C(C1(OCC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3)(C(=O)O)O

Isomeric SMILES

C1COC(=O)C(C1(OCC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3)(C(=O)O)O

InChI

InChI=1S/C19H16Cl2O8S/c20-13-7-6-12(15(21)10-13)11-29-18(30(26,27)14-4-2-1-3-5-14)8-9-28-17(24)19(18,25)16(22)23/h1-7,10,25H,8-9,11H2,(H,22,23)