[3,4-bis(fluoranyl)phenyl]-isothiocyanato-methanone

Systemtic Name: [3,4-bis(fluoranyl)phenyl]-isothiocyanato-methanone Openeye Name: 3,4-difluorobenzoyl isothiocyanate CAS Name: (3,4-difluorophenyl)-isothiocyanatomethanone IUPAC Name: 3,4-difluorobenzoyl isothiocyanate Traditional Name: (3,4-difluorophenyl)-isothiocyanato-methanone Formula: C8H3F2NOS MolecularWeight: 199.177326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N=C=S)F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N=C=S)F)F

InChI

InChI=1S/C8H3F2NOS/c9-6-2-1-5(3-7(6)10)8(12)11-4-13/h1-3H