[4,8-bis(oxidanylidene)-2-adamantyl] thiocyanate

Systemtic Name: [4,8-bis(oxidanylidene)-2-adamantyl] thiocyanate Openeye Name: (4,8-dioxo-2-adamantyl) thiocyanate CAS Name: thiocyanic acid (4,8-dioxo-2-adamantyl) ester IUPAC Name: (4,8-dioxo-2-adamantyl) thiocyanate Traditional Name: thiocyanic acid (4,8-diketo-2-adamantyl) ester Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3C(C(C2=O)CC1C3=O)SC#N

Isomeric SMILES

C1C2CC3C(C(C2=O)CC1C3=O)SC#N

InChI

InChI=1S/C11H11NO2S/c12-4-15-11-7-2-5-1-6(10(7)14)3-8(11)9(5)13/h5-8,11H,1-3H2