(1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-[[(2R)-2-oxolanyl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium Traditional Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C26H40N4O+2 MolecularWeight: 424.622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3CCCO3)CC4=C(NN=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](C[C@H]3CCCO3)CC4=C(NN=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H38N4O/c1-2-7-22(8-3-1)26-23(17-27-28-26)19-29(20-25-11-6-16-31-25)18-21-12-14-30(15-13-21)24-9-4-5-10-24/h1-3,7-8,17,21,24-25H,4-6,9-16,18-20H2,(H,27,28)/p+2/t25-/m1/s1