N-[(3aS,4S,5S,6S,7S,7aS)-5-bromanyl-7-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethyl-6-oxidanyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(3aS,4S,5S,6S,7S,7aS)-5-bromanyl-7-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethyl-6-oxidanyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[(3aS,4S,5S,6S,7S,7aS)-5-bromo-7-[tert-butyl(dimethyl)silyl]oxy-6-hydroxy-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitro-benzenesulfonamide CAS Name: N-[(3aS,4S,5S,6S,7S,7aS)-5-bromo-7-[tert-butyl(dimethyl)silyl]oxy-6-hydroxy-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(3aS,4S,5S,6S,7S,7aS)-5-bromo-7-[tert-butyl(dimethyl)silyl]oxy-6-hydroxy-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[(3aS,4S,5S,6S,7S,7aS)-5-bromo-7-[tert-butyl(dimethyl)silyl]oxy-6-hydroxy-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]-4-nitro-benzenesulfonamide Formula: C21H33BrN2O8SSi MolecularWeight: 581.54982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(C(C(C(C2O1)O[Si](C)(C)C(C)(C)C)O)Br)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(O[C@H]2[C@@H]([C@@H]([C@H]([C@@H]([C@H]2O1)O[Si](C)(C)C(C)(C)C)O)Br)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H33BrN2O8SSi/c1-20(2,3)34(6,7)32-18-16(25)14(22)15(17-19(18)31-21(4,5)30-17)23-33(28,29)13-10-8-12(9-11-13)24(26)27/h8-11,14-19,23,25H,1-7H3/t14-,15+,16+,17-,18-,19-/m0/s1