[3-methyl-2,4-bis(oxidanylidene)pentan-3-yl] thiocyanate

Systemtic Name: [3-methyl-2,4-bis(oxidanylidene)pentan-3-yl] thiocyanate Openeye Name: (1-acetyl-1-methyl-2-oxo-propyl) thiocyanate CAS Name: thiocyanic acid (3-methyl-2,4-dioxopentan-3-yl) ester IUPAC Name: (3-methyl-2,4-dioxopentan-3-yl) thiocyanate Traditional Name: thiocyanic acid (1-acetyl-2-keto-1-methyl-propyl) ester Formula: C7H9NO2S MolecularWeight: 171.21686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C(=O)C)SC#N

Isomeric SMILES

CC(=O)C(C)(C(=O)C)SC#N

InChI

InChI=1S/C7H9NO2S/c1-5(9)7(3,6(2)10)11-4-8/h1-3H3