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

Systemtic Name: N-[(2S)-butan-2-yl]-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]furan-3-carboxamide Openeye Name: N-[(1S)-1-methylpropyl]-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propyl]furan-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxopropyl]-3-furancarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxopropyl]furan-3-carboxamide Traditional Name: N-[3-keto-3-(2-morpholin-4-ium-4-ylethylamino)propyl]-N-[(1S)-1-methylpropyl]-3-furamide Formula: C18H30N3O4+ MolecularWeight: 352.4485

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O4/c1-3-15(2)21(18(23)16-5-11-25-14-16)7-4-17(22)19-6-8-20-9-12-24-13-10-20/h5,11,14-15H,3-4,6-10,12-13H2,1-2H3,(H,19,22)/p+1/t15-/m0/s1