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

Systemtic Name: [2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium ethanoate Openeye Name: allyl-[2-[(2E)-2-[(5-nitro-2-furyl)methylene]hydrazino]-2-oxo-ethyl]ammonium acetate CAS Name: [2-[(2E)-2-[(5-nitro-2-furanyl)methylidene]hydrazinyl]-2-oxoethyl]-prop-2-enylammonium acetate IUPAC Name: [2-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-2-oxoethyl]-prop-2-enylazanium acetate Traditional Name: allyl-[2-keto-2-[(N'E)-N'-[(5-nitro-2-furyl)methylene]hydrazino]ethyl]ammonium acetate Formula: C12H16N4O6 MolecularWeight: 312.27864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N4O4.C2H4O2/c1-2-5-11-7-9(15)13-12-6-8-3-4-10(18-8)14(16)17;1-2(3)4/h2-4,6,11H,1,5,7H2,(H,13,15);1H3,(H,3,4)/b12-6+;