2,5-dimethyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide Openeye Name: N-isopentyl-2,5-dimethyl-N-[3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide CAS Name: 2,5-dimethyl-N-(3-methylbutyl)-N-[3-oxo-3-[2-(1-piperidin-1-iumyl)ethylamino]propyl]-3-furancarboxamide IUPAC Name: 2,5-dimethyl-N-(3-methylbutyl)-N-[3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)propyl]furan-3-carboxamide Traditional Name: N-isoamyl-N-[3-keto-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-2,5-dimethyl-3-furamide Formula: C22H38N3O3+ MolecularWeight: 392.55542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H37N3O3/c1-17(2)8-13-25(22(27)20-16-18(3)28-19(20)4)14-9-21(26)23-10-15-24-11-6-5-7-12-24/h16-17H,5-15H2,1-4H3,(H,23,26)/p+1