3-isothiocyanato-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-isothiocyanato-1-azabicyclo[2.2.2]octane Openeye Name: 3-isothiocyanatoquinuclidine CAS Name: 3-isothiocyanato-1-azabicyclo[2.2.2]octane IUPAC Name: 3-isothiocyanato-1-azabicyclo[2.2.2]octane Traditional Name: 3-isothiocyanatoquinuclidine Formula: C8H12N2S MolecularWeight: 168.25928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N=C=S

Isomeric SMILES

C1CN2CCC1C(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