(1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-[(4-methoxycarbonylphenyl)methyl]-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-methoxycarbonylphenyl)methyl]-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: (4-carbomethoxybenzyl)-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C25H40N2O3+2 MolecularWeight: 416.5967

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C[NH+](CC2CC[NH+](CC2)C3CCCC3)CC4CCCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C[NH+](C[C@H]2CCCO2)CC3CC[NH+](CC3)C4CCCC4

InChI

InChI=1S/C25H38N2O3/c1-29-25(28)22-10-8-20(9-11-22)17-26(19-24-7-4-16-30-24)18-21-12-14-27(15-13-21)23-5-2-3-6-23/h8-11,21,23-24H,2-7,12-19H2,1H3/p+2/t24-/m1/s1