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

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-3-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-3-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propanamide CAS Name: N-(4-chloro-2-fluorophenyl)-3-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]propanamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-3-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-3-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propionamide Formula: C17H19ClFN2OS+ MolecularWeight: 353.861963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CCC(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC=CS3

Isomeric SMILES

C1C[C@H]([NH+](C1)CCC(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC=CS3

InChI

InChI=1S/C17H18ClFN2OS/c18-12-5-6-14(13(19)11-12)20-17(22)7-9-21-8-1-3-15(21)16-4-2-10-23-16/h2,4-6,10-11,15H,1,3,7-9H2,(H,20,22)/p+1/t15-/m0/s1