1-chloranyl-4-isothiocyanato-2-(trifluoromethyl)cyclohexane

Systemtic Name: 1-chloranyl-4-isothiocyanato-2-(trifluoromethyl)cyclohexane Openeye Name: 1-chloro-4-isothiocyanato-2-(trifluoromethyl)cyclohexane CAS Name: 1-chloro-4-isothiocyanato-2-(trifluoromethyl)cyclohexane IUPAC Name: 1-chloro-4-isothiocyanato-2-(trifluoromethyl)cyclohexane Traditional Name: 1-chloro-4-isothiocyanato-2-(trifluoromethyl)cyclohexane Formula: C8H9ClF3NS MolecularWeight: 243.67697

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1N=C=S)C(F)(F)F)Cl

Isomeric SMILES

C1CC(C(CC1N=C=S)C(F)(F)F)Cl

InChI

InChI=1S/C8H9ClF3NS/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h5-7H,1-3H2