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

Systemtic Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-hydroxypiperidin-1-ium-1-yl)piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-(4-dibenzofuranylmethyl)-4-(4-hydroxy-1-piperidin-1-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-hydroxypiperidin-1-ium-1-yl)piperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-hydroxypiperidin-1-ium-1-yl)piperidin-1-ium-3-ol Formula: C23H30N2O3+2 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)C2CC[NH+](CC2O)CC3=CC=CC4=C3OC5=CC=CC=C45

Isomeric SMILES

C1C[NH+](C[C@H]([C@@H]1[NH+]2CCC(CC2)O)O)CC3=CC=CC4=C3OC5=CC=CC=C45

InChI

InChI=1S/C23H28N2O3/c26-17-8-12-25(13-9-17)20-10-11-24(15-21(20)27)14-16-4-3-6-19-18-5-1-2-7-22(18)28-23(16)19/h1-7,17,20-21,26-27H,8-15H2/p+2/t20-,21-/m1/s1