3-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide

Systemtic Name: 3-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide Openeye Name: 3-[1-(benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide CAS Name: 3-[1-(2-benzofuranylmethyl)-4-piperidin-1-iumyl]-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]propanamide IUPAC Name: 3-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide Traditional Name: 3-[1-(benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propionamide Formula: C24H37N3O2+2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)CCC2CC[NH+](CC2)CC3=CC4=CC=CC=C4O3

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)CCC2CC[NH+](CC2)CC3=CC4=CC=CC=C4O3

InChI

InChI=1S/C24H35N3O2/c1-2-27-13-5-7-21(27)17-25-24(28)10-9-19-11-14-26(15-12-19)18-22-16-20-6-3-4-8-23(20)29-22/h3-4,6,8,16,19,21H,2,5,7,9-15,17-18H2,1H3,(H,25,28)/p+2/t21-/m0/s1