2-[2-(6-methoxy-1-benzofuran-3-yl)ethanoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 2-[2-(6-methoxy-1-benzofuran-3-yl)ethanoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 2-[[2-(6-methoxybenzofuran-3-yl)acetyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 2-[[2-(6-methoxy-3-benzofuranyl)-1-oxoethyl]amino]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 2-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 2-[[2-(6-methoxybenzofuran-3-yl)acetyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C25H30N3O5+ MolecularWeight: 452.5228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC=CC=C3C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC=CC=C3C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C25H29N3O5/c1-31-19-7-8-20-18(17-33-23(20)16-19)15-24(29)27-22-6-3-2-5-21(22)25(30)26-9-4-10-28-11-13-32-14-12-28/h2-3,5-8,16-17H,4,9-15H2,1H3,(H,26,30)(H,27,29)/p+1