(2,2-dicyano-2-oxidanyl-1-phenyl-ethyl) thiocyanate

Systemtic Name: (2,2-dicyano-2-oxidanyl-1-phenyl-ethyl) thiocyanate Openeye Name: (2,2-dicyano-2-hydroxy-1-phenyl-ethyl) thiocyanate CAS Name: thiocyanic acid (2,2-dicyano-2-hydroxy-1-phenylethyl) ester IUPAC Name: (2,2-dicyano-2-hydroxy-1-phenylethyl) thiocyanate Traditional Name: thiocyanic acid (2,2-dicyano-2-hydroxy-1-phenyl-ethyl) ester Formula: C11H7N3OS MolecularWeight: 229.25778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7N3OS/c12-6-11(15,7-13)10(16-8-14)9-4-2-1-3-5-9/h1-5,10,15H