[4-[[(2R)-oxan-2-yl]methyl]-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [4-[[(2R)-oxan-2-yl]methyl]-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-yl]methanol CAS Name: [4-[[(2R)-2-oxanyl]methyl]-1-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [4-[[(2R)-oxan-2-yl]methyl]-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-yl]methanol Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CC2(CC[NH+](CC2)CC3=CC=CN3C4=CN=CC=C4)CO

Isomeric SMILES

C1CCO[C@H](C1)CC2(CC[NH+](CC2)CC3=CC=CN3C4=CN=CC=C4)CO

InChI

InChI=1S/C22H31N3O2/c26-18-22(15-21-7-1-2-14-27-21)8-12-24(13-9-22)17-20-6-4-11-25(20)19-5-3-10-23-16-19/h3-6,10-11,16,21,26H,1-2,7-9,12-15,17-18H2/p+1/t21-/m1/s1