2-[6-[[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]methyl]-4-oxidanylidene-pyran-3-yl]oxy-N-methyl-ethanamide

Systemtic Name: 2-[6-[[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]methyl]-4-oxidanylidene-pyran-3-yl]oxy-N-methyl-ethanamide Openeye Name: 2-[6-[[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]methyl]-4-oxo-pyran-3-yl]oxy-N-methyl-acetamide CAS Name: 2-[[6-[[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]methyl]-4-oxo-3-pyranyl]oxy]-N-methylacetamide IUPAC Name: 2-[6-[[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]methyl]-4-oxopyran-3-yl]oxy-N-methylacetamide Traditional Name: 2-[6-[[4-(2-furoyl)piperazin-1-ium-1-yl]methyl]-4-keto-pyran-3-yl]oxy-N-methyl-acetamide Formula: C18H22N3O6+ MolecularWeight: 376.38378

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC1=COC(=CC1=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CNC(=O)COC1=COC(=CC1=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N3O6/c1-19-17(23)12-27-16-11-26-13(9-14(16)22)10-20-4-6-21(7-5-20)18(24)15-3-2-8-25-15/h2-3,8-9,11H,4-7,10,12H2,1H3,(H,19,23)/p+1