1-isothiocyanato-3-(trifluoromethyl)benzene

Systemtic Name: 1-isothiocyanato-3-(trifluoromethyl)benzene Openeye Name: 1-isothiocyanato-3-(trifluoromethyl)benzene CAS Name: 1-isothiocyanato-3-(trifluoromethyl)benzene IUPAC Name: 1-isothiocyanato-3-(trifluoromethyl)benzene Traditional Name: 1-isothiocyanato-3-(trifluoromethyl)benzene Formula: C8H4F3NS MolecularWeight: 203.18427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=C=S)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N=C=S)C(F)(F)F

InChI

InChI=1S/C8H4F3NS/c9-8(10,11)6-2-1-3-7(4-6)12-5-13/h1-4H