N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(5-nitrofuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(5-nitrofuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-(5-nitrofuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[4-[(5-nitro-2-furanyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(5-nitrofuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[4-(5-nitro-2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C15H18N5O6+ MolecularWeight: 364.33332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O6/c1-10-8-12(17-26-10)16-13(21)9-18-4-6-19(7-5-18)15(22)11-2-3-14(25-11)20(23)24/h2-3,8H,4-7,9H2,1H3,(H,16,17,21)/p+1