2,5-dimethyl-N-[3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-N-[[(2R)-oxolan-2-yl]methyl]furan-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-N-[[(2R)-oxolan-2-yl]methyl]furan-3-carboxamide Openeye Name: 2,5-dimethyl-N-[3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]furan-3-carboxamide CAS Name: 2,5-dimethyl-N-[[(2R)-2-oxolanyl]methyl]-N-[3-oxo-3-[2-(1-piperidin-1-iumyl)ethylamino]propyl]-3-furancarboxamide IUPAC Name: 2,5-dimethyl-N-[[(2R)-oxolan-2-yl]methyl]-N-[3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide Traditional Name: N-[3-keto-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-2,5-dimethyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-furamide Formula: C22H36N3O4+ MolecularWeight: 406.53894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N(CCC(=O)NCC[NH+]2CCCCC2)CC3CCCO3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N(CCC(=O)NCC[NH+]2CCCCC2)C[C@H]3CCCO3

InChI

InChI=1S/C22H35N3O4/c1-17-15-20(18(2)29-17)22(27)25(16-19-7-6-14-28-19)12-8-21(26)23-9-13-24-10-4-3-5-11-24/h15,19H,3-14,16H2,1-2H3,(H,23,26)/p+1/t19-/m1/s1