(3-oxidanylidene-1-phenyl-butan-2-yl) thiocyanate

Systemtic Name: (3-oxidanylidene-1-phenyl-butan-2-yl) thiocyanate Openeye Name: (1-benzyl-2-oxo-propyl) thiocyanate CAS Name: thiocyanic acid (3-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (3-oxo-1-phenylbutan-2-yl) thiocyanate Traditional Name: thiocyanic acid (1-benzyl-2-keto-propyl) ester Formula: C11H11NOS MolecularWeight: 205.27614

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)SC#N

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)SC#N

InChI

InChI=1S/C11H11NOS/c1-9(13)11(14-8-12)7-10-5-3-2-4-6-10/h2-6,11H,7H2,1H3