(1S,2R,3R,4S,6R)-4,6-bis(azanyl)-3-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]methoxy]cyclohexane-1,2-diol

Systemtic Name: (1S,2R,3R,4S,6R)-4,6-bis(azanyl)-3-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]methoxy]cyclohexane-1,2-diol Openeye Name: (1S,2R,3R,4S,6R)-4,6-diamino-3-[(2,3,4,5,6-pentafluorophenyl)methoxy]cyclohexane-1,2-diol CAS Name: (1S,2R,3R,4S,6R)-4,6-diamino-3-[(2,3,4,5,6-pentafluorophenyl)methoxy]cyclohexane-1,2-diol IUPAC Name: (1S,2R,3R,4S,6R)-4,6-diamino-3-[(2,3,4,5,6-pentafluorophenyl)methoxy]cyclohexane-1,2-diol Traditional Name: (1S,2R,3R,4S,6R)-4,6-diamino-3-(2,3,4,5,6-pentafluorobenzyl)oxy-cyclohexane-1,2-diol Formula: C13H15F5N2O3 MolecularWeight: 342.261816

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1N)OCC2=C(C(=C(C(=C2F)F)F)F)F)O)O)N

Isomeric SMILES

C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)OCC2=C(C(=C(C(=C2F)F)F)F)F)O)O)N

InChI

InChI=1S/C13H15F5N2O3/c14-6-3(7(15)9(17)10(18)8(6)16)2-23-13-5(20)1-4(19)11(21)12(13)22/h4-5,11-13,21-22H,1-2,19-20H2/t4-,5+,11+,12-,13-/m1/s1