(3-oxidanylidene-1,3-diphenyl-propyl) thiocyanate

Systemtic Name: (3-oxidanylidene-1,3-diphenyl-propyl) thiocyanate Openeye Name: (3-oxo-1,3-diphenyl-propyl) thiocyanate CAS Name: thiocyanic acid (3-oxo-1,3-diphenylpropyl) ester IUPAC Name: (3-oxo-1,3-diphenylpropyl) thiocyanate Traditional Name: thiocyanic acid (3-keto-1,3-diphenyl-propyl) ester Formula: C16H13NOS MolecularWeight: 267.34552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)SC#N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)SC#N

InChI

InChI=1S/C16H13NOS/c17-12-19-16(14-9-5-2-6-10-14)11-15(18)13-7-3-1-4-8-13/h1-10,16H,11H2