6-nitro-7-propyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-nitro-7-propyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-nitro-7-propyl-4H-1,4-benzoxazin-3-one CAS Name: 6-nitro-7-propyl-4H-1,4-benzoxazin-3-one IUPAC Name: 6-nitro-7-propyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-nitro-7-propyl-4H-1,4-benzoxazin-3-one Formula: C11H12N2O4 MolecularWeight: 236.22398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1[N+](=O)[O-])NC(=O)CO2

Isomeric SMILES

CCCC1=CC2=C(C=C1[N+](=O)[O-])NC(=O)CO2

InChI

InChI=1S/C11H12N2O4/c1-2-3-7-4-10-8(5-9(7)13(15)16)12-11(14)6-17-10/h4-5H,2-3,6H2,1H3,(H,12,14)