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

Systemtic Name: [(2S)-1-[(2-bromanyl-4-fluoranyl-phenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(2-bromo-4-fluoro-phenyl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(2-bromo-4-fluoroanilino)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-bromo-4-fluoroanilino)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-[(2-bromo-4-fluoro-phenyl)carbamoyl]-3-methyl-butyl]ammonium Formula: C12H17BrFN2O+ MolecularWeight: 304.178583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16BrFN2O/c1-7(2)5-10(15)12(17)16-11-4-3-8(14)6-9(11)13/h3-4,6-7,10H,5,15H2,1-2H3,(H,16,17)/p+1/t10-/m0/s1