(2S)-N-[(4-fluorophenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-[(4-fluorophenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-[(4-fluorophenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-[(4-fluorophenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(4-fluorobenzyl)pyrrolidin-1-ium-2-carboxamide Formula: C12H16FN2O+ MolecularWeight: 223.266643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1C[C@H]([NH2+]C1)C(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C12H15FN2O/c13-10-5-3-9(4-6-10)8-15-12(16)11-2-1-7-14-11/h3-6,11,14H,1-2,7-8H2,(H,15,16)/p+1/t11-/m0/s1