[(2S)-1-[(2-bromanyl-4-fluoranyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2-bromanyl-4-fluoranyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(2-bromo-4-fluoro-phenyl)carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(2-bromo-4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-bromo-4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(2-bromo-4-fluoro-phenyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C11H15BrFN2O+ MolecularWeight: 290.152003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=C(C=C1)F)Br)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=C(C=C(C=C1)F)Br)[NH3+]

InChI

InChI=1S/C11H14BrFN2O/c1-6(2)10(14)11(16)15-9-4-3-7(13)5-8(9)12/h3-6,10H,14H2,1-2H3,(H,15,16)/p+1/t10-/m0/s1