1-[4-azanyl-3-bromanyl-5-(trifluoromethyl)phenyl]-2-(propan-2-ylamino)ethanone hydrochloride

Systemtic Name: 1-[4-azanyl-3-bromanyl-5-(trifluoromethyl)phenyl]-2-(propan-2-ylamino)ethanone hydrochloride Openeye Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(isopropylamino)ethanone hydrochloride CAS Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(propan-2-ylamino)ethanone hydrochloride IUPAC Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(propan-2-ylamino)ethanone hydrochloride Traditional Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(isopropylamino)ethanone hydrochloride Formula: C12H15BrClF3N2O MolecularWeight: 375.61251

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrF3N2O.ClH/c1-6(2)18-5-10(19)7-3-8(12(14,15)16)11(17)9(13)4-7;/h3-4,6,18H,5,17H2,1-2H3;1H