2,3,4,5,6-pentaacetyloxy-2-(2,4-dimethyl-1,3-thiazol-5-yl)hexanoic acid

Systemtic Name: 2,3,4,5,6-pentaacetyloxy-2-(2,4-dimethyl-1,3-thiazol-5-yl)hexanoic acid Openeye Name: 2,3,4,5,6-pentaacetoxy-2-(2,4-dimethylthiazol-5-yl)hexanoic acid CAS Name: 2,3,4,5,6-pentaacetyloxy-2-(2,4-dimethyl-5-thiazolyl)hexanoic acid IUPAC Name: 2,3,4,5,6-pentaacetyloxy-2-(2,4-dimethyl-1,3-thiazol-5-yl)hexanoic acid Traditional Name: 2,3,4,5,6-pentaacetoxy-2-(2,4-dimethylthiazol-5-yl)hexanoic acid Formula: C21H27NO12S MolecularWeight: 517.50358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)(C(=O)O)OC(=O)C

Isomeric SMILES

CC1=C(SC(=N1)C)C(C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)(C(=O)O)OC(=O)C

InChI

InChI=1S/C21H27NO12S/c1-9-19(35-10(2)22-9)21(20(28)29,34-15(7)27)18(33-14(6)26)17(32-13(5)25)16(31-12(4)24)8-30-11(3)23/h16-18H,8H2,1-7H3,(H,28,29)