ethanoic acid; 6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-triazin-3-amine

Systemtic Name: ethanoic acid; 6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-triazin-3-amine Openeye Name: acetic acid; 6-[(E)-2-(5-nitro-2-furyl)vinyl]-1,2,4-triazin-3-amine CAS Name: acetic acid; 6-[(E)-2-(5-nitro-2-furanyl)ethenyl]-1,2,4-triazin-3-amine IUPAC Name: acetic acid; 6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-triazin-3-amine Traditional Name: acetic acid; [6-[(E)-2-(5-nitro-2-furyl)vinyl]-1,2,4-triazin-3-yl]amine Formula: C11H11N5O5 MolecularWeight: 293.23554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=C(OC(=C1)[N+](=O)[O-])C=CC2=CN=C(N=N2)N

Isomeric SMILES

CC(=O)O.C1=C(OC(=C1)[N+](=O)[O-])/C=C/C2=CN=C(N=N2)N

InChI

InChI=1S/C9H7N5O3.C2H4O2/c10-9-11-5-6(12-13-9)1-2-7-3-4-8(17-7)14(15)16;1-2(3)4/h1-5H,(H2,10,11,13);1H3,(H,3,4)/b2-1+;