(2,6-dimethyl-6-thiocyanato-heptan-2-yl) thiocyanate

Systemtic Name: (2,6-dimethyl-6-thiocyanato-heptan-2-yl) thiocyanate Openeye Name: (1,1,5-trimethyl-5-thiocyanato-hexyl) thiocyanate CAS Name: thiocyanic acid (2,6-dimethyl-6-thiocyanatoheptan-2-yl) ester IUPAC Name: (2,6-dimethyl-6-thiocyanatoheptan-2-yl) thiocyanate Traditional Name: thiocyanic acid (1,1,5-trimethyl-5-thiocyanato-hexyl) ester Formula: C11H18N2S2 MolecularWeight: 242.40402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C)(C)SC#N)SC#N

Isomeric SMILES

CC(C)(CCCC(C)(C)SC#N)SC#N

InChI

InChI=1S/C11H18N2S2/c1-10(2,14-8-12)6-5-7-11(3,4)15-9-13/h5-7H2,1-4H3