3-azanyl-6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2H-1,2,4-triazin-5-one

Systemtic Name: 3-azanyl-6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-amino-6-[(E)-2-(5-nitro-2-furyl)vinyl]-2H-1,2,4-triazin-5-one CAS Name: 3-amino-6-[(E)-2-(5-nitro-2-furanyl)ethenyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-amino-6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-amino-6-[(E)-2-(5-nitro-2-furyl)vinyl]-2H-1,2,4-triazin-5-one Formula: C9H7N5O4 MolecularWeight: 249.18298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)[N+](=O)[O-])C=CC2=NNC(=NC2=O)N

Isomeric SMILES

C1=C(OC(=C1)[N+](=O)[O-])/C=C/C2=NNC(=NC2=O)N

InChI

InChI=1S/C9H7N5O4/c10-9-11-8(15)6(12-13-9)3-1-5-2-4-7(18-5)14(16)17/h1-4H,(H3,10,11,13,15)/b3-1+