ethyl 2,2-dimethyl-6-thiocyanato-hexanoate

Systemtic Name: ethyl 2,2-dimethyl-6-thiocyanato-hexanoate Openeye Name: ethyl 2,2-dimethyl-6-thiocyanato-hexanoate CAS Name: 2,2-dimethyl-6-thiocyanatohexanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-6-thiocyanatohexanoate Traditional Name: 2,2-dimethyl-6-thiocyanato-hexanoic acid ethyl ester Formula: C11H19NO2S MolecularWeight: 229.33906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCSC#N

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCSC#N

InChI

InChI=1S/C11H19NO2S/c1-4-14-10(13)11(2,3)7-5-6-8-15-9-12/h4-8H2,1-3H3