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

Systemtic Name: [(2S)-1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [(1S)-2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [(2S)-1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl]-(2-furanylmethyl)-methylammonium IUPAC Name: [(2S)-1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [(1S)-2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C15H17BrFN2O2+ MolecularWeight: 356.210083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)[NH+](C)CC2=CC=CO2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)Br)F)[NH+](C)CC2=CC=CO2

InChI

InChI=1S/C15H16BrFN2O2/c1-10(19(2)9-12-4-3-7-21-12)15(20)18-14-6-5-11(16)8-13(14)17/h3-8,10H,9H2,1-2H3,(H,18,20)/p+1/t10-/m0/s1