1-benzothiophen-2-ylmethyl-methyl-[[4-[1-[(2R)-oxolan-2-yl]carbonylpiperidin-4-yl]oxyphenyl]methyl]azanium

Systemtic Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[1-[(2R)-oxolan-2-yl]carbonylpiperidin-4-yl]oxyphenyl]methyl]azanium Openeye Name: benzothiophen-2-ylmethyl-methyl-[[4-[[1-[(2R)-tetrahydrofuran-2-carbonyl]-4-piperidyl]oxy]phenyl]methyl]ammonium CAS Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[[1-[oxo-[(2R)-2-oxolanyl]methyl]-4-piperidinyl]oxy]phenyl]methyl]ammonium IUPAC Name: 1-benzothiophen-2-ylmethyl-methyl-[[4-[1-[(2R)-oxolane-2-carbonyl]piperidin-4-yl]oxyphenyl]methyl]azanium Traditional Name: benzothiophen-2-ylmethyl-methyl-[4-[[1-[(2R)-tetrahydrofuran-2-carbonyl]-4-piperidyl]oxy]benzyl]ammonium Formula: C27H33N2O3S+ MolecularWeight: 465.62752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C3CCCO3)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)[C@H]3CCCO3)CC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C27H32N2O3S/c1-28(19-24-17-21-5-2-3-7-26(21)33-24)18-20-8-10-22(11-9-20)32-23-12-14-29(15-13-23)27(30)25-6-4-16-31-25/h2-3,5,7-11,17,23,25H,4,6,12-16,18-19H2,1H3/p+1/t25-/m1/s1