[4-(propanoylamino)-2-(trifluoromethyl)phenyl] thiocyanate

Systemtic Name: [4-(propanoylamino)-2-(trifluoromethyl)phenyl] thiocyanate Openeye Name: [4-(propanoylamino)-2-(trifluoromethyl)phenyl] thiocyanate CAS Name: thiocyanic acid [4-(1-oxopropylamino)-2-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(propanoylamino)-2-(trifluoromethyl)phenyl] thiocyanate Traditional Name: thiocyanic acid [4-propionamido-2-(trifluoromethyl)phenyl] ester Formula: C11H9F3N2OS MolecularWeight: 274.26217

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)SC#N)C(F)(F)F

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)SC#N)C(F)(F)F

InChI

InChI=1S/C11H9F3N2OS/c1-2-10(17)16-7-3-4-9(18-6-15)8(5-7)11(12,13)14/h3-5H,2H2,1H3,(H,16,17)