(3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-cyclobutyl-4-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-ium-3-ol Formula: C19H30FN3O+2 MolecularWeight: 335.459403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[NH+]2CCC(C(C2)O)[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CC(C1)[NH+]2CC[C@H]([C@@H](C2)O)[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C19H28FN3O/c20-16-6-1-2-7-17(16)21-10-12-22(13-11-21)18-8-9-23(14-19(18)24)15-4-3-5-15/h1-2,6-7,15,18-19,24H,3-5,8-14H2/p+2/t18-,19-/m1/s1