N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-piperonyl-acetamide Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCC[NH+]2CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C=CC=C1[C@H]2CCC[NH+]2CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H23N3O3/c1-21-8-2-4-15(21)16-5-3-9-22(16)12-19(23)20-11-14-6-7-17-18(10-14)25-13-24-17/h2,4,6-8,10,16H,3,5,9,11-13H2,1H3,(H,20,23)/p+1/t16-/m1/s1