3,5-bis(fluoranyl)-4-isothiocyanato-benzaldehyde

Systemtic Name: 3,5-bis(fluoranyl)-4-isothiocyanato-benzaldehyde Openeye Name: 3,5-difluoro-4-isothiocyanato-benzaldehyde CAS Name: 3,5-difluoro-4-isothiocyanatobenzaldehyde IUPAC Name: 3,5-difluoro-4-isothiocyanatobenzaldehyde Traditional Name: 3,5-difluoro-4-isothiocyanato-benzaldehyde Formula: C8H3F2NOS MolecularWeight: 199.177326

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1F)N=C=S)F)C=O

Isomeric SMILES

C1=C(C=C(C(=C1F)N=C=S)F)C=O

InChI

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