N-(2-cyanophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(2-cyanophenyl)-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(2-cyanophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C17H18N3OS+ MolecularWeight: 312.40932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC2=CC=CC=C2C#N)C3=CC=CS3

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC(=O)NC2=CC=CC=C2C#N)C3=CC=CS3

InChI

InChI=1S/C17H17N3OS/c18-11-13-5-1-2-6-14(13)19-17(21)12-20-9-3-7-15(20)16-8-4-10-22-16/h1-2,4-6,8,10,15H,3,7,9,12H2,(H,19,21)/p+1/t15-/m1/s1