2,3-dihydro-1,4-benzoxazin-4-yl-(3,5-dinitro-4-oxidanyl-phenyl)methanone

Systemtic Name: 2,3-dihydro-1,4-benzoxazin-4-yl-(3,5-dinitro-4-oxidanyl-phenyl)methanone Openeye Name: 2,3-dihydro-1,4-benzoxazin-4-yl-(4-hydroxy-3,5-dinitro-phenyl)methanone CAS Name: 2,3-dihydro-1,4-benzoxazin-4-yl-(4-hydroxy-3,5-dinitrophenyl)methanone IUPAC Name: 2,3-dihydro-1,4-benzoxazin-4-yl-(4-hydroxy-3,5-dinitrophenyl)methanone Traditional Name: 2,3-dihydro-1,4-benzoxazin-4-yl-(4-hydroxy-3,5-dinitro-phenyl)methanone Formula: C15H11N3O7 MolecularWeight: 345.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N1C(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1COC2=CC=CC=C2N1C(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O7/c19-14-11(17(21)22)7-9(8-12(14)18(23)24)15(20)16-5-6-25-13-4-2-1-3-10(13)16/h1-4,7-8,19H,5-6H2