3-[[4-(hydroxymethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 3-[[4-(hydroxymethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 3-[[4-(hydroxymethyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-1-yl]methyl]phenol CAS Name: 3-[[4-(hydroxymethyl)-4-[[(2R)-2-oxanyl]methyl]-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 3-[[4-(hydroxymethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-1-yl]methyl]phenol Traditional Name: 3-[[4-methylol-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-1-yl]methyl]phenol Formula: C19H30NO3+ MolecularWeight: 320.4464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CC2(CC[NH+](CC2)CC3=CC(=CC=C3)O)CO

Isomeric SMILES

C1CCO[C@H](C1)CC2(CC[NH+](CC2)CC3=CC(=CC=C3)O)CO

InChI

InChI=1S/C19H29NO3/c21-15-19(13-18-6-1-2-11-23-18)7-9-20(10-8-19)14-16-4-3-5-17(22)12-16/h3-5,12,18,21-22H,1-2,6-11,13-15H2/p+1/t18-/m1/s1