5-oxidanyl-3,4-bis(phenylcarbonyloxy)-6-phenylsulfanyl-oxane-2-carboxylic acid

Systemtic Name: 5-oxidanyl-3,4-bis(phenylcarbonyloxy)-6-phenylsulfanyl-oxane-2-carboxylic acid Openeye Name: 3,4-dibenzoyloxy-5-hydroxy-6-phenylsulfanyl-tetrahydropyran-2-carboxylic acid CAS Name: 3,4-dibenzoyloxy-5-hydroxy-6-(phenylthio)-2-oxanecarboxylic acid IUPAC Name: 3,4-dibenzoyloxy-5-hydroxy-6-phenylsulfanyloxane-2-carboxylic acid Traditional Name: 3,4-dibenzoyloxy-5-hydroxy-6-(phenylthio)tetrahydropyran-2-carboxylic acid Formula: C26H22O8S MolecularWeight: 494.51308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C(C(OC(C2OC(=O)C3=CC=CC=C3)C(=O)O)SC4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2C(C(OC(C2OC(=O)C3=CC=CC=C3)C(=O)O)SC4=CC=CC=C4)O

InChI

InChI=1S/C26H22O8S/c27-19-20(32-24(30)16-10-4-1-5-11-16)21(33-25(31)17-12-6-2-7-13-17)22(23(28)29)34-26(19)35-18-14-8-3-9-15-18/h1-15,19-22,26-27H,(H,28,29)