2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)ethanamide

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)ethanamide Openeye Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(1H-pyrazol-4-yl)acetamide Formula: C13H11N5O5 MolecularWeight: 317.25694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NC3=CNN=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)NC3=CNN=C3

InChI

InChI=1S/C13H11N5O5/c19-12(16-8-4-14-15-5-8)6-17-10-3-9(18(21)22)1-2-11(10)23-7-13(17)20/h1-5H,6-7H2,(H,14,15)(H,16,19)