(2S,4R)-N-[3,5-bis(fluoranyl)phenyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N-[3,5-bis(fluoranyl)phenyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-N-(3,5-difluorophenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N-(3,5-difluorophenyl)-4-hydroxy-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N-(3,5-difluorophenyl)-4-hydroxypyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-N-(3,5-difluorophenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide Formula: C11H13F2N2O2+ MolecularWeight: 243.229926

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)NC2=CC(=CC(=C2)F)F)O

Isomeric SMILES

C1[C@H](C[NH2+][C@@H]1C(=O)NC2=CC(=CC(=C2)F)F)O

InChI

InChI=1S/C11H12F2N2O2/c12-6-1-7(13)3-8(2-6)15-11(17)10-4-9(16)5-14-10/h1-3,9-10,14,16H,4-5H2,(H,15,17)/p+1/t9-,10+/m1/s1