N-(3-nitrophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-nitrophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(3-nitrophenyl)-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(3-nitrophenyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C16H18N3O3S+ MolecularWeight: 332.39742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S/c20-16(17-12-4-1-5-13(10-12)19(21)22)11-18-8-2-6-14(18)15-7-3-9-23-15/h1,3-5,7,9-10,14H,2,6,8,11H2,(H,17,20)/p+1/t14-/m1/s1