(6-methyl-5-nitro-3-oxidanyl-1-benzofuran-2-yl) 2-oxidanylidenepropanoate

Systemtic Name: (6-methyl-5-nitro-3-oxidanyl-1-benzofuran-2-yl) 2-oxidanylidenepropanoate Openeye Name: (3-hydroxy-6-methyl-5-nitro-benzofuran-2-yl) 2-oxopropanoate CAS Name: 2-oxopropanoic acid (3-hydroxy-6-methyl-5-nitro-2-benzofuranyl) ester IUPAC Name: (3-hydroxy-6-methyl-5-nitro-1-benzofuran-2-yl) 2-oxopropanoate Traditional Name: 2-ketopropionic acid (3-hydroxy-6-methyl-5-nitro-benzofuran-2-yl) ester Formula: C12H9NO7 MolecularWeight: 279.20236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C2O)OC(=O)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C2O)OC(=O)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO7/c1-5-3-9-7(4-8(5)13(17)18)10(15)12(19-9)20-11(16)6(2)14/h3-4,15H,1-2H3