2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide Formula: C17H19N4O5+ MolecularWeight: 359.35656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C3=CC=CO3

InChI

InChI=1S/C17H18N4O5/c22-16(18-13-3-1-4-14(11-13)21(24)25)12-19-6-8-20(9-7-19)17(23)15-5-2-10-26-15/h1-5,10-11H,6-9,12H2,(H,18,22)/p+1