1-[(2R)-3-[4-methoxy-2-[(4-methoxypiperidin-1-ium-1-yl)methyl]phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(2R)-3-[4-methoxy-2-[(4-methoxypiperidin-1-ium-1-yl)methyl]phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(4-methoxypiperidin-1-ium-1-yl)methyl]phenoxy]propyl]piperidin-1-ium-4-ol CAS Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(4-methoxy-1-piperidin-1-iumyl)methyl]phenoxy]propyl]-4-piperidin-1-iumol IUPAC Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(4-methoxypiperidin-1-ium-1-yl)methyl]phenoxy]propyl]piperidin-1-ium-4-ol Traditional Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(4-methoxypiperidin-1-ium-1-yl)methyl]phenoxy]propyl]piperidin-1-ium-4-ol Formula: C22H38N2O5+2 MolecularWeight: 410.54752

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC[NH+](CC1)CC2=C(C=CC(=C2)OC)OCC(C[NH+]3CCC(CC3)O)O

Isomeric SMILES

COC1CC[NH+](CC1)CC2=C(C=CC(=C2)OC)OC[C@@H](C[NH+]3CCC(CC3)O)O

InChI

InChI=1S/C22H36N2O5/c1-27-20-7-11-23(12-8-20)14-17-13-21(28-2)3-4-22(17)29-16-19(26)15-24-9-5-18(25)6-10-24/h3-4,13,18-20,25-26H,5-12,14-16H2,1-2H3/p+2/t19-/m1/s1