2-(4-fluorophenyl)ethyl-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 2-(4-fluorophenyl)ethyl-[(1S)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(2-furanylmethylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]azanium Traditional Name: 2-(4-fluorophenyl)ethyl-[(1S)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C16H20FN2O2+ MolecularWeight: 291.340603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)[NH2+]CCC2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)[NH2+]CCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2O2/c1-12(16(20)19-11-15-3-2-10-21-15)18-9-8-13-4-6-14(17)7-5-13/h2-7,10,12,18H,8-9,11H2,1H3,(H,19,20)/p+1/t12-/m0/s1