(2S)-N-[3,4-bis(fluoranyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-[3,4-bis(fluoranyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-(3,4-difluorophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(3,4-difluorophenyl)-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(3,4-difluorophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(3,4-difluorophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propionamide Formula: C17H19F2N2OS+ MolecularWeight: 337.407366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)F)[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)F)F)[NH+]2CCC[C@@H]2C3=CC=CS3

InChI

InChI=1S/C17H18F2N2OS/c1-11(17(22)20-12-6-7-13(18)14(19)10-12)21-8-2-4-15(21)16-5-3-9-23-16/h3,5-7,9-11,15H,2,4,8H2,1H3,(H,20,22)/p+1/t11-,15+/m0/s1