N-[[(3S)-1-ethyl-5-oxidanylidene-pyrrolidin-3-yl]methyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[[(3S)-1-ethyl-5-oxidanylidene-pyrrolidin-3-yl]methyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-[[(3S)-1-ethyl-5-oxo-pyrrolidin-3-yl]methyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[[(3S)-1-ethyl-5-oxo-3-pyrrolidinyl]methyl]-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[[(3S)-1-ethyl-5-oxopyrrolidin-3-yl]methyl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-[[(3S)-1-ethyl-5-keto-pyrrolidin-3-yl]methyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C25H33N4O3+ MolecularWeight: 437.55452

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1=O)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CCN1C[C@@H](CC1=O)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C25H32N4O3/c1-2-29-17-19(15-24(29)30)16-27-25(31)20-6-8-22(9-7-20)32-23-10-13-28(14-11-23)18-21-5-3-4-12-26-21/h3-9,12,19,23H,2,10-11,13-18H2,1H3,(H,27,31)/p+1/t19-/m0/s1