2,1,3-benzoxadiazol-4-ylmethyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2S)-oxolan-2-yl]methyl]azanium

Systemtic Name: 2,1,3-benzoxadiazol-4-ylmethyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2S)-oxolan-2-yl]methyl]azanium Openeye Name: 2,1,3-benzoxadiazol-4-ylmethyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: 2,1,3-benzoxadiazol-4-ylmethyl-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-[[(2S)-2-oxolanyl]methyl]ammonium IUPAC Name: 2,1,3-benzoxadiazol-4-ylmethyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2S)-oxolan-2-yl]methyl]azanium Traditional Name: benzofurazan-4-ylmethyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2S)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C23H36N4O2+2 MolecularWeight: 400.55754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3CCCO3)CC4=CC=CC5=NON=C54

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](C[C@@H]3CCCO3)CC4=CC=CC5=NON=C54

InChI

InChI=1S/C23H34N4O2/c1-2-7-20(6-1)27-12-10-18(11-13-27)15-26(17-21-8-4-14-28-21)16-19-5-3-9-22-23(19)25-29-24-22/h3,5,9,18,20-21H,1-2,4,6-8,10-17H2/p+2/t21-/m0/s1