4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]benzamide Openeye Name: N-[[(3R)-1-isopropylpyrrolidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: 4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]-N-[[(3R)-1-propan-2-yl-3-pyrrolidin-1-iumyl]methyl]benzamide IUPAC Name: 4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]benzamide Traditional Name: N-[[(3R)-1-isopropylpyrrolidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C28H41N3O2+2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(C1)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)[NH+]1CC[C@@H](C1)CNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O2/c1-22(2)31-19-13-24(21-31)20-29-28(32)25-8-10-26(11-9-25)33-27-14-17-30(18-15-27)16-12-23-6-4-3-5-7-23/h3-11,22,24,27H,12-21H2,1-2H3,(H,29,32)/p+2/t24-/m1/s1