2-thiocyanatohexyl ethanoate

Systemtic Name: 2-thiocyanatohexyl ethanoate Openeye Name: 2-thiocyanatohexyl acetate CAS Name: acetic acid 2-thiocyanatohexyl ester IUPAC Name: 2-thiocyanatohexyl acetate Traditional Name: acetic acid 2-thiocyanatohexyl ester Formula: C9H15NO2S MolecularWeight: 201.2859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(COC(=O)C)SC#N

Isomeric SMILES

CCCCC(COC(=O)C)SC#N

InChI

InChI=1S/C9H15NO2S/c1-3-4-5-9(13-7-10)6-12-8(2)11/h9H,3-6H2,1-2H3