(2S)-1-[(4-fluorophenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(4-fluorophenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(4-fluorophenyl)methyl]-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(4-fluorophenyl)methyl]-N-[2-(3-pyridinyloxy)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(4-fluorophenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-(4-fluorobenzyl)-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C23H23FN3O2+ MolecularWeight: 392.446023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

Isomeric SMILES

C1C[C@H]([NH+](C1)CC2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

InChI

InChI=1S/C23H22FN3O2/c24-18-11-9-17(10-12-18)16-27-14-4-7-21(27)23(28)26-20-6-1-2-8-22(20)29-19-5-3-13-25-15-19/h1-3,5-6,8-13,15,21H,4,7,14,16H2,(H,26,28)/p+1/t21-/m0/s1