[6-(4-bromophenyl)sulfonyl-3,4,5-tris(oxidanyl)oxan-2-yl]methyl ethanoate

Systemtic Name: [6-(4-bromophenyl)sulfonyl-3,4,5-tris(oxidanyl)oxan-2-yl]methyl ethanoate Openeye Name: [6-(4-bromophenyl)sulfonyl-3,4,5-trihydroxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [6-(4-bromophenyl)sulfonyl-3,4,5-trihydroxy-2-oxanyl]methyl ester IUPAC Name: [6-(4-bromophenyl)sulfonyl-3,4,5-trihydroxyoxan-2-yl]methyl acetate Traditional Name: acetic acid (6-brosyl-3,4,5-trihydroxy-tetrahydropyran-2-yl)methyl ester Formula: C14H17BrO8S MolecularWeight: 425.24898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)O)O)O

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)O)O)O

InChI

InChI=1S/C14H17BrO8S/c1-7(16)22-6-10-11(17)12(18)13(19)14(23-10)24(20,21)9-4-2-8(15)3-5-9/h2-5,10-14,17-19H,6H2,1H3