4-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethyl]amino]benzamide IUPAC Name: 4-[[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C17H20N3O2S+ MolecularWeight: 330.4246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O2S/c18-17(22)12-5-7-13(8-6-12)19-16(21)11-20-9-1-3-14(20)15-4-2-10-23-15/h2,4-8,10,14H,1,3,9,11H2,(H2,18,22)(H,19,21)/p+1/t14-/m1/s1