2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(5-methoxy-2-methyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(5-methoxy-2-methyl-4-nitro-phenyl)ethanamide Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(5-methoxy-2-methyl-4-nitro-phenyl)acetamide CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(5-methoxy-2-methyl-4-nitrophenyl)acetamide Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-N-(5-methoxy-2-methyl-4-nitro-phenyl)acetamide Formula: C19H23N4O6+ MolecularWeight: 403.40912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O6/c1-13-10-15(23(26)27)17(28-2)11-14(13)20-18(24)12-21-5-7-22(8-6-21)19(25)16-4-3-9-29-16/h3-4,9-11H,5-8,12H2,1-2H3,(H,20,24)/p+1