[(3S)-3-thiomorpholin-4-yl-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium

Systemtic Name: [(3S)-3-thiomorpholin-4-yl-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium Openeye Name: [(3S)-3-thiomorpholinoquinuclidin-1-ium-3-yl]methylammonium CAS Name: [(3S)-3-thiomorpholin-4-yl-1-azoniabicyclo[2.2.2]octan-3-yl]methylammonium IUPAC Name: [(3S)-3-thiomorpholin-4-yl-1-azoniabicyclo[2.2.2]octan-3-yl]methylazanium Traditional Name: [(3S)-3-thiomorpholinoquinuclidin-1-ium-3-yl]methylammonium Formula: C12H25N3S+2 MolecularWeight: 243.412

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)(C[NH3+])N3CCSCC3

Isomeric SMILES

C1C[NH+]2CCC1[C@@](C2)(C[NH3+])N3CCSCC3

InChI

InChI=1S/C12H23N3S/c13-9-12(15-5-7-16-8-6-15)10-14-3-1-11(12)2-4-14/h11H,1-10,13H2/p+2/t12-/m0/s1