4-[bis(fluoranyl)methoxy]-2-bromanyl-1-isothiocyanato-benzene

Systemtic Name: 4-[bis(fluoranyl)methoxy]-2-bromanyl-1-isothiocyanato-benzene Openeye Name: 2-bromo-4-(difluoromethoxy)-1-isothiocyanato-benzene CAS Name: 2-bromo-4-(difluoromethoxy)-1-isothiocyanatobenzene IUPAC Name: 2-bromo-4-(difluoromethoxy)-1-isothiocyanatobenzene Traditional Name: 2-bromo-4-(difluoromethoxy)-1-isothiocyanato-benzene Formula: C8H4BrF2NOS MolecularWeight: 280.089266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC(F)F)Br)N=C=S

Isomeric SMILES

C1=CC(=C(C=C1OC(F)F)Br)N=C=S

InChI

InChI=1S/C8H4BrF2NOS/c9-6-3-5(13-8(10)11)1-2-7(6)12-4-14/h1-3,8H