2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide CAS Name: 2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide Formula: C17H21N4O3+ MolecularWeight: 329.37364

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCC[NH+]2CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1[C@H]2CCC[NH+]2CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c1-19-10-2-4-15(19)16-5-3-11-20(16)12-17(22)18-13-6-8-14(9-7-13)21(23)24/h2,4,6-10,16H,3,5,11-12H2,1H3,(H,18,22)/p+1/t16-/m1/s1