1-(4-azanyl-3-bromanyl-5-fluoranyl-phenyl)-2-(tert-butylamino)ethanone hydrochloride

Systemtic Name: 1-(4-azanyl-3-bromanyl-5-fluoranyl-phenyl)-2-(tert-butylamino)ethanone hydrochloride Openeye Name: 1-(4-amino-3-bromo-5-fluoro-phenyl)-2-(tert-butylamino)ethanone hydrochloride CAS Name: 1-(4-amino-3-bromo-5-fluorophenyl)-2-(tert-butylamino)ethanone hydrochloride IUPAC Name: 1-(4-amino-3-bromo-5-fluorophenyl)-2-(tert-butylamino)ethanone hydrochloride Traditional Name: 1-(4-amino-3-bromo-5-fluoro-phenyl)-2-(tert-butylamino)ethanone hydrochloride Formula: C12H17BrClFN2O MolecularWeight: 339.631583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(=O)C1=CC(=C(C(=C1)Br)N)F.Cl

Isomeric SMILES

CC(C)(C)NCC(=O)C1=CC(=C(C(=C1)Br)N)F.Cl

InChI

InChI=1S/C12H16BrFN2O.ClH/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7;/h4-5,16H,6,15H2,1-3H3;1H