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

Systemtic Name: 1-[4-azanyl-3-bromanyl-5-(trifluoromethyl)phenyl]-2-(cyclopropylamino)ethanone hydrochloride Openeye Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(cyclopropylamino)ethanone hydrochloride CAS Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(cyclopropylamino)ethanone hydrochloride IUPAC Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(cyclopropylamino)ethanone hydrochloride Traditional Name: 1-[4-amino-3-bromo-5-(trifluoromethyl)phenyl]-2-(cyclopropylamino)ethanone hydrochloride Formula: C12H13BrClF3N2O MolecularWeight: 373.59663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC(=O)C2=CC(=C(C(=C2)Br)N)C(F)(F)F.Cl

Isomeric SMILES

C1CC1NCC(=O)C2=CC(=C(C(=C2)Br)N)C(F)(F)F.Cl

InChI

InChI=1S/C12H12BrF3N2O.ClH/c13-9-4-6(10(19)5-18-7-1-2-7)3-8(11(9)17)12(14,15)16;/h3-4,7,18H,1-2,5,17H2;1H