[3,4,5-tris(phenylcarbonyloxy)-6-sulfanyl-oxan-2-yl]methyl benzoate

Systemtic Name: [3,4,5-tris(phenylcarbonyloxy)-6-sulfanyl-oxan-2-yl]methyl benzoate Openeye Name: (3,4,5-tribenzoyloxy-6-sulfanyl-tetrahydropyran-2-yl)methyl benzoate CAS Name: benzoic acid (3,4,5-tribenzoyloxy-6-mercapto-2-oxanyl)methyl ester IUPAC Name: (3,4,5-tribenzoyloxy-6-sulfanyloxan-2-yl)methyl benzoate Traditional Name: benzoic acid (3,4,5-tribenzoyloxy-6-mercapto-tetrahydropyran-2-yl)methyl ester Formula: C34H28O9S MolecularWeight: 612.64572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)S)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)S)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C34H28O9S/c35-30(22-13-5-1-6-14-22)39-21-26-27(41-31(36)23-15-7-2-8-16-23)28(42-32(37)24-17-9-3-10-18-24)29(34(44)40-26)43-33(38)25-19-11-4-12-20-25/h1-20,26-29,34,44H,21H2