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

Systemtic Name: [(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(4-fluorophenyl)-1-piperazinyl]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[4-(4-fluorophenyl)piperazino]-2-keto-1-methyl-ethyl]ammonium Formula: C13H19FN3O+ MolecularWeight: 252.307863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)[NH3+]

InChI

InChI=1S/C13H18FN3O/c1-10(15)13(18)17-8-6-16(7-9-17)12-4-2-11(14)3-5-12/h2-5,10H,6-9,15H2,1H3/p+1/t10-/m0/s1