[1-(4-chlorophenyl)-2,2-dicyano-2-oxidanyl-ethyl] thiocyanate

Systemtic Name: [1-(4-chlorophenyl)-2,2-dicyano-2-oxidanyl-ethyl] thiocyanate Openeye Name: [1-(4-chlorophenyl)-2,2-dicyano-2-hydroxy-ethyl] thiocyanate CAS Name: thiocyanic acid [1-(4-chlorophenyl)-2,2-dicyano-2-hydroxyethyl] ester IUPAC Name: [1-(4-chlorophenyl)-2,2-dicyano-2-hydroxyethyl] thiocyanate Traditional Name: thiocyanic acid [1-(4-chlorophenyl)-2,2-dicyano-2-hydroxy-ethyl] ester Formula: C11H6ClN3OS MolecularWeight: 263.70284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(C#N)(C#N)O)SC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C(C#N)(C#N)O)SC#N)Cl

InChI

InChI=1S/C11H6ClN3OS/c12-9-3-1-8(2-4-9)10(17-7-15)11(16,5-13)6-14/h1-4,10,16H