(6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) 2-nitrobenzoate

Systemtic Name: (6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) 2-nitrobenzoate Openeye Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) ester IUPAC Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (2-keto-6-methyl-3-nitro-1H-pyridin-4-yl) ester Formula: C13H9N3O7 MolecularWeight: 319.22646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O7/c1-7-6-10(11(16(21)22)12(17)14-7)23-13(18)8-4-2-3-5-9(8)15(19)20/h2-6H,1H3,(H,14,17)