N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-oxidanylidene-N-[[(2R)-oxolan-2-yl]methyl]-6,7-dihydro-5H-1-benzofuran-3-carboxamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-oxidanylidene-N-[[(2R)-oxolan-2-yl]methyl]-6,7-dihydro-5H-1-benzofuran-3-carboxamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-oxo-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-6,7-dihydro-5H-benzofuran-3-carboxamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-4-oxo-N-[[(2R)-2-oxolanyl]methyl]-6,7-dihydro-5H-benzofuran-3-carboxamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-6,7-dihydro-5H-1-benzofuran-3-carboxamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-4-keto-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-6,7-dihydro-5H-benzofuran-3-carboxamide Formula: C25H37N2O4+ MolecularWeight: 429.57228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)CN(CC3CCCO3)C(=O)C4=COC5=C4C(=O)CCC5

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)CN(C[C@H]3CCCO3)C(=O)C4=COC5=C4C(=O)CCC5

InChI

InChI=1S/C25H36N2O4/c28-22-8-3-9-23-24(22)21(17-31-23)25(29)27(16-20-7-4-14-30-20)15-18-10-12-26(13-11-18)19-5-1-2-6-19/h17-20H,1-16H2/p+1/t20-/m1/s1