N-(2-methylpropyl)-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]furan-3-carboxamide

Systemtic Name: N-(2-methylpropyl)-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]furan-3-carboxamide Openeye Name: N-isobutyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propyl]furan-3-carboxamide CAS Name: N-(2-methylpropyl)-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxopropyl]-3-furancarboxamide IUPAC Name: N-(2-methylpropyl)-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxopropyl]furan-3-carboxamide Traditional Name: N-isobutyl-N-[3-keto-3-(2-morpholin-4-ium-4-ylethylamino)propyl]-3-furamide Formula: C18H30N3O4+ MolecularWeight: 352.4485

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC(=O)NCC[NH+]1CCOCC1)C(=O)C2=COC=C2

Isomeric SMILES

CC(C)CN(CCC(=O)NCC[NH+]1CCOCC1)C(=O)C2=COC=C2

InChI

InChI=1S/C18H29N3O4/c1-15(2)13-21(18(23)16-4-10-25-14-16)6-3-17(22)19-5-7-20-8-11-24-12-9-20/h4,10,14-15H,3,5-9,11-13H2,1-2H3,(H,19,22)/p+1