[1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-yl]methanol CAS Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-2-oxanyl]methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-yl]methanol Formula: C20H30NO4+ MolecularWeight: 348.4565

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CC2(CC[NH+](CC2)CC3=C4C(=CC=C3)OCO4)CO

Isomeric SMILES

C1CCO[C@H](C1)CC2(CC[NH+](CC2)CC3=C4C(=CC=C3)OCO4)CO

InChI

InChI=1S/C20H29NO4/c22-14-20(12-17-5-1-2-11-23-17)7-9-21(10-8-20)13-16-4-3-6-18-19(16)25-15-24-18/h3-4,6,17,22H,1-2,5,7-15H2/p+1/t17-/m1/s1