(3R)-3-isothiocyanato-1-azoniabicyclo[2.2.2]octane

Systemtic Name: (3R)-3-isothiocyanato-1-azoniabicyclo[2.2.2]octane Openeye Name: (3R)-3-isothiocyanatoquinuclidin-1-ium CAS Name: (3R)-3-isothiocyanato-1-azoniabicyclo[2.2.2]octane IUPAC Name: (3R)-3-isothiocyanato-1-azoniabicyclo[2.2.2]octane Traditional Name: (3R)-3-isothiocyanatoquinuclidin-1-ium Formula: C8H13N2S+ MolecularWeight: 169.26722

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)N=C=S

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)N=C=S

InChI

InChI=1S/C8H12N2S/c11-6-9-8-5-10-3-1-7(8)2-4-10/h7-8H,1-5H2/p+1/t8-/m0/s1