ethyl 2,2-dimethyl-5-thiocyanato-pentanoate

Systemtic Name: ethyl 2,2-dimethyl-5-thiocyanato-pentanoate Openeye Name: ethyl 2,2-dimethyl-5-thiocyanato-pentanoate CAS Name: 2,2-dimethyl-5-thiocyanatopentanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-5-thiocyanatopentanoate Traditional Name: 2,2-dimethyl-5-thiocyanato-valeric acid ethyl ester Formula: C10H17NO2S MolecularWeight: 215.31248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO2S/c1-4-13-9(12)10(2,3)6-5-7-14-8-11/h4-7H2,1-3H3