[4-(trifluoromethyl)phenyl]methyl thiocyanate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl thiocyanate Openeye Name: [4-(trifluoromethyl)phenyl]methyl thiocyanate CAS Name: thiocyanic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl thiocyanate Traditional Name: thiocyanic acid [4-(trifluoromethyl)benzyl] ester Formula: C9H6F3NS MolecularWeight: 217.21085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CSC#N)C(F)(F)F

InChI

InChI=1S/C9H6F3NS/c10-9(11,12)8-3-1-7(2-4-8)5-14-6-13/h1-4H,5H2