[1,3-bis(oxidanylidene)-1-phenyl-butan-2-yl] thiocyanate

Systemtic Name: [1,3-bis(oxidanylidene)-1-phenyl-butan-2-yl] thiocyanate Openeye Name: (1-benzoyl-2-oxo-propyl) thiocyanate CAS Name: thiocyanic acid (1,3-dioxo-1-phenylbutan-2-yl) ester IUPAC Name: (1,3-dioxo-1-phenylbutan-2-yl) thiocyanate Traditional Name: thiocyanic acid (1-benzoyl-2-keto-propyl) ester Formula: C11H9NO2S MolecularWeight: 219.25966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C1=CC=CC=C1)SC#N

Isomeric SMILES

CC(=O)C(C(=O)C1=CC=CC=C1)SC#N

InChI

InChI=1S/C11H9NO2S/c1-8(13)11(15-7-12)10(14)9-5-3-2-4-6-9/h2-6,11H,1H3