(3-chloranyl-2-fluoranyl-phenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium

Systemtic Name: (3-chloranyl-2-fluoranyl-phenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium Openeye Name: (3-chloro-2-fluoro-phenyl)-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: (3-chloro-2-fluorophenyl)-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]ammonium IUPAC Name: (3-chloro-2-fluorophenyl)-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]azanium Traditional Name: (3-chloro-2-fluoro-phenyl)-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethyl]ammonium Formula: C13H17ClFN2O+ MolecularWeight: 271.738283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)[NH2+]C2=C(C(=CC=C2)Cl)F

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1)[NH2+]C2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C13H16ClFN2O/c1-9(13(18)17-7-2-3-8-17)16-11-6-4-5-10(14)12(11)15/h4-6,9,16H,2-3,7-8H2,1H3/p+1/t9-/m0/s1