[2-methyl-4,5,6-tri(propanoyloxy)thian-3-yl] 2,2-dimethylbutanoate

Systemtic Name: [2-methyl-4,5,6-tri(propanoyloxy)thian-3-yl] 2,2-dimethylbutanoate Openeye Name: [2-methyl-4,5,6-tri(propanoyloxy)tetrahydrothiopyran-3-yl] 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid [2-methyl-4,5,6-tris(1-oxopropoxy)-3-thianyl] ester IUPAC Name: [2-methyl-4,5,6-tri(propanoyloxy)thian-3-yl] 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid (2-methyl-4,5,6-tripropionyloxy-tetrahydrothiopyran-3-yl) ester Formula: C21H34O8S MolecularWeight: 446.55486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1C(C(SC(C1OC(=O)CC)OC(=O)CC)C)OC(=O)C(C)(C)CC

Isomeric SMILES

CCC(=O)OC1C(C(SC(C1OC(=O)CC)OC(=O)CC)C)OC(=O)C(C)(C)CC

InChI

InChI=1S/C21H34O8S/c1-8-13(22)26-17-16(29-20(25)21(6,7)11-4)12(5)30-19(28-15(24)10-3)18(17)27-14(23)9-2/h12,16-19H,8-11H2,1-7H3