2-methylpropyl-[2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]azanium ethanoate

Systemtic Name: 2-methylpropyl-[2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]azanium ethanoate Openeye Name: isobutyl-[2-[(2E)-2-[(5-nitro-2-furyl)methylene]hydrazino]-2-oxo-ethyl]ammonium acetate CAS Name: 2-methylpropyl-[2-[(2E)-2-[(5-nitro-2-furanyl)methylidene]hydrazinyl]-2-oxoethyl]ammonium acetate IUPAC Name: 2-methylpropyl-[2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxoethyl]azanium acetate Traditional Name: isobutyl-[2-keto-2-[(N'E)-N'-[(5-nitro-2-furyl)methylene]hydrazino]ethyl]ammonium acetate Formula: C13H20N4O6 MolecularWeight: 328.3211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC(=O)NN=CC1=CC=C(O1)[N+](=O)[O-].CC(=O)[O-]

Isomeric SMILES

CC(C)C[NH2+]CC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-].CC(=O)[O-]

InChI

InChI=1S/C11H16N4O4.C2H4O2/c1-8(2)5-12-7-10(16)14-13-6-9-3-4-11(19-9)15(17)18;1-2(3)4/h3-4,6,8,12H,5,7H2,1-2H3,(H,14,16);1H3,(H,3,4)/b13-6+;