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

Systemtic Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-(4-dibenzofuranylmethyl)-4-(4-methyl-1-piperazin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-(dibenzofuran-4-ylmethyl)-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Formula: C23H31N3O2+2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CC[NH+](CC2O)CC3=CC=CC4=C3OC5=CC=CC=C45

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H]2CC[NH+](C[C@H]2O)CC3=CC=CC4=C3OC5=CC=CC=C45

InChI

InChI=1S/C23H29N3O2/c1-24-11-13-26(14-12-24)20-9-10-25(16-21(20)27)15-17-5-4-7-19-18-6-2-3-8-22(18)28-23(17)19/h2-8,20-21,27H,9-16H2,1H3/p+2/t20-,21-/m1/s1