[(3S,4R)-5-acetyloxy-4-(4-methoxyphenyl)carbonyloxy-thiolan-3-yl] 4-methoxybenzoate

Systemtic Name: [(3S,4R)-5-acetyloxy-4-(4-methoxyphenyl)carbonyloxy-thiolan-3-yl] 4-methoxybenzoate Openeye Name: [(3S,4R)-5-acetoxy-4-(4-methoxybenzoyl)oxy-tetrahydrothiophen-3-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(3S,4R)-5-acetyloxy-4-[(4-methoxyphenyl)-oxomethoxy]-3-thiolanyl] ester IUPAC Name: [(3S,4R)-5-acetyloxy-4-(4-methoxybenzoyl)oxythiolan-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(3S,4R)-5-acetoxy-4-p-anisoyloxy-tetrahydrothiophen-3-yl] ester Formula: C22H22O8S MolecularWeight: 446.47028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(CS1)OC(=O)C2=CC=C(C=C2)OC)OC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)OC1[C@@H]([C@@H](CS1)OC(=O)C2=CC=C(C=C2)OC)OC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22O8S/c1-13(23)28-22-19(30-21(25)15-6-10-17(27-3)11-7-15)18(12-31-22)29-20(24)14-4-8-16(26-2)9-5-14/h4-11,18-19,22H,12H2,1-3H3/t18-,19-,22?/m1/s1