2-(bromomethyl)-4-fluoranyl-1-isothiocyanato-benzene

Systemtic Name: 2-(bromomethyl)-4-fluoranyl-1-isothiocyanato-benzene Openeye Name: 2-(bromomethyl)-4-fluoro-1-isothiocyanato-benzene CAS Name: 2-(bromomethyl)-4-fluoro-1-isothiocyanatobenzene IUPAC Name: 2-(bromomethyl)-4-fluoro-1-isothiocyanatobenzene Traditional Name: 2-(bromomethyl)-4-fluoro-1-isothiocyanato-benzene Formula: C8H5BrFNS MolecularWeight: 246.099403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CBr)N=C=S

Isomeric SMILES

C1=CC(=C(C=C1F)CBr)N=C=S

InChI

InChI=1S/C8H5BrFNS/c9-4-6-3-7(10)1-2-8(6)11-5-12/h1-3H,4H2