N-(2,5-dimethylpyrazol-3-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(2,5-dimethylpyrazol-3-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(2,5-dimethylpyrazol-3-yl)-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C15H15N5O5 MolecularWeight: 345.3101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C15H15N5O5/c1-9-5-13(18(2)17-9)16-14(21)7-19-11-6-10(20(23)24)3-4-12(11)25-8-15(19)22/h3-6H,7-8H2,1-2H3,(H,16,21)