[(1S,2S,8aS)-1-oxidanyl-3-oxidanylidene-2,5,6,7,8,8a-hexahydro-1H-indolizin-2-yl] 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: [(1S,2S,8aS)-1-oxidanyl-3-oxidanylidene-2,5,6,7,8,8a-hexahydro-1H-indolizin-2-yl] 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: [(1S,2S,8aS)-1-hydroxy-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-2-yl] 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid [(1S,2S,8aS)-1-hydroxy-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-2-yl] ester IUPAC Name: [(1S,2S,8aS)-1-hydroxy-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizin-2-yl] 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid [(1S,2S,8aS)-1-hydroxy-3-keto-indolizidin-2-yl] ester Formula: C23H35NO5S MolecularWeight: 437.5927

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC2C(C3CCCCN3C2=O)O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)O[C@H]2[C@H]([C@@H]3CCCCN3C2=O)O)C(C)C

InChI

InChI=1S/C23H35NO5S/c1-13(2)16-11-17(14(3)4)22(18(12-16)15(5)6)30(27,28)29-21-20(25)19-9-7-8-10-24(19)23(21)26/h11-15,19-21,25H,7-10H2,1-6H3/t19-,20-,21-/m0/s1