(3R,4R)-1-(naphthalen-1-ylmethyl)-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-(naphthalen-1-ylmethyl)-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-ium-3-ol Openeye Name: (3R,4R)-4-(4-hydroxypiperidin-1-ium-1-yl)-1-(1-naphthylmethyl)piperidin-1-ium-3-ol CAS Name: (3R,4R)-4-(4-hydroxy-1-piperidin-1-iumyl)-1-(1-naphthalenylmethyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-4-(4-hydroxypiperidin-1-ium-1-yl)-1-(naphthalen-1-ylmethyl)piperidin-1-ium-3-ol Traditional Name: (3R,4R)-4-(4-hydroxypiperidin-1-ium-1-yl)-1-(1-naphthylmethyl)piperidin-1-ium-3-ol Formula: C21H30N2O2+2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)C2CC[NH+](CC2O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1C[NH+](C[C@H]([C@@H]1[NH+]2CCC(CC2)O)O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H28N2O2/c24-18-8-12-23(13-9-18)20-10-11-22(15-21(20)25)14-17-6-3-5-16-4-1-2-7-19(16)17/h1-7,18,20-21,24-25H,8-15H2/p+2/t20-,21-/m1/s1