2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(3-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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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