[(3R)-3-(3-phenylpropyl)-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-3-yl]methanol

Systemtic Name: [(3R)-3-(3-phenylpropyl)-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-3-yl]methanol Openeye Name: [(3R)-3-(3-phenylpropyl)-1-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]-3-piperidyl]methanol CAS Name: [(3R)-3-(3-phenylpropyl)-1-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-3-piperidinyl]methanol IUPAC Name: [(3R)-3-(3-phenylpropyl)-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]piperidin-3-yl]methanol Traditional Name: [(3R)-3-(3-phenylpropyl)-1-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]-3-piperidyl]methanol Formula: C26H38N3O+ MolecularWeight: 408.59942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CC[NH+](CC2)CC3=CN=CC=C3)(CCCC4=CC=CC=C4)CO

Isomeric SMILES

C1C[C@@](CN(C1)C2CC[NH+](CC2)CC3=CN=CC=C3)(CCCC4=CC=CC=C4)CO

InChI

InChI=1S/C26H37N3O/c30-22-26(13-4-9-23-7-2-1-3-8-23)14-6-16-29(21-26)25-11-17-28(18-12-25)20-24-10-5-15-27-19-24/h1-3,5,7-8,10,15,19,25,30H,4,6,9,11-14,16-18,20-22H2/p+1/t26-/m1/s1