[(2S,3R,4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-oxidanyl-hex-5-yn-2-yl] 4-nitrobenzoate

Systemtic Name: [(2S,3R,4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-oxidanyl-hex-5-yn-2-yl] 4-nitrobenzoate Openeye Name: [(1S,2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxy-1-methyl-pent-4-ynyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,3R,4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxyhex-5-yn-2-yl] ester IUPAC Name: [(2S,3R,4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxyhex-5-yn-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S,2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxy-1-methyl-pent-4-ynyl] ester Formula: C19H27NO6Si MolecularWeight: 393.50628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C#C)O[Si](C)(C)C(C)(C)C)O)OC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]([C@H]([C@H](C#C)O[Si](C)(C)C(C)(C)C)O)OC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C19H27NO6Si/c1-8-16(26-27(6,7)19(3,4)5)17(21)13(2)25-18(22)14-9-11-15(12-10-14)20(23)24/h1,9-13,16-17,21H,2-7H3/t13-,16-,17+/m0/s1