9-nitro-1-oxidanylidene-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid

Systemtic Name: 9-nitro-1-oxidanylidene-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid Openeye Name: 9-nitro-1-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid CAS Name: 9-nitro-1-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid IUPAC Name: 9-nitro-1-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid Traditional Name: 1-keto-9-nitro-5H-pyrimido[2,1-c][1,4]benzoxazine-2-carboxylic acid Formula: C12H7N3O6 MolecularWeight: 289.20048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=C(C(=O)N2C3=C(O1)C=CC(=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C2=NC=C(C(=O)N2C3=C(O1)C=CC(=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H7N3O6/c16-11-7(12(17)18)4-13-10-5-21-9-2-1-6(15(19)20)3-8(9)14(10)11/h1-4H,5H2,(H,17,18)