2-bromanyl-1-(4-isothiocyanatophenyl)ethanone

Systemtic Name: 2-bromanyl-1-(4-isothiocyanatophenyl)ethanone Openeye Name: 2-bromo-1-(4-isothiocyanatophenyl)ethanone CAS Name: 2-bromo-1-(4-isothiocyanatophenyl)ethanone IUPAC Name: 2-bromo-1-(4-isothiocyanatophenyl)ethanone Traditional Name: 2-bromo-1-(4-isothiocyanatophenyl)ethanone Formula: C9H6BrNOS MolecularWeight: 256.11904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6BrNOS/c10-5-9(12)7-1-3-8(4-2-7)11-6-13/h1-4H,5H2