[(2S,3S)-3-azido-2-oxidanyl-4-phenyl-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: [(2S,3S)-3-azido-2-oxidanyl-4-phenyl-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: [(2S,3S)-3-azido-2-hydroxy-4-phenyl-butyl] 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid [(2S,3S)-3-azido-2-hydroxy-4-phenylbutyl] ester IUPAC Name: [(2S,3S)-3-azido-2-hydroxy-4-phenylbutyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid [(2S,3S)-3-azido-2-hydroxy-4-phenyl-butyl] ester Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCC(C(CC2=CC=CC=C2)N=[N+]=[N-])O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC[C@H]([C@H](CC2=CC=CC=C2)N=[N+]=[N-])O)C(C)C

InChI

InChI=1S/C25H35N3O4S/c1-16(2)20-13-21(17(3)4)25(22(14-20)18(5)6)33(30,31)32-15-24(29)23(27-28-26)12-19-10-8-7-9-11-19/h7-11,13-14,16-18,23-24,29H,12,15H2,1-6H3/t23-,24+/m0/s1