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

Systemtic Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 2-(4-fluorophenyl)ethyl-[(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: 2-(4-fluorophenyl)ethyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]azanium Traditional Name: 2-(4-fluorophenyl)ethyl-[(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]ammonium Formula: C13H19FN3O2+ MolecularWeight: 268.307263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH2+]CCC1=CC=C(C=C1)F

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)[NH2+]CCC1=CC=C(C=C1)F

InChI

InChI=1S/C13H18FN3O2/c1-9(12(18)17-13(19)15-2)16-8-7-10-3-5-11(14)6-4-10/h3-6,9,16H,7-8H2,1-2H3,(H2,15,17,18,19)/p+1/t9-/m0/s1