(4,6-dinitro-5-oxidanyl-1-benzofuran-3-yl)-(4-methoxyphenyl)methanone

Systemtic Name: (4,6-dinitro-5-oxidanyl-1-benzofuran-3-yl)-(4-methoxyphenyl)methanone Openeye Name: (5-hydroxy-4,6-dinitro-benzofuran-3-yl)-(4-methoxyphenyl)methanone CAS Name: (5-hydroxy-4,6-dinitro-3-benzofuranyl)-(4-methoxyphenyl)methanone IUPAC Name: (5-hydroxy-4,6-dinitro-1-benzofuran-3-yl)-(4-methoxyphenyl)methanone Traditional Name: (5-hydroxy-4,6-dinitro-benzofuran-3-yl)-(4-methoxyphenyl)methanone Formula: C16H10N2O8 MolecularWeight: 358.2592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=COC3=C2C(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=COC3=C2C(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O8/c1-25-9-4-2-8(3-5-9)15(19)10-7-26-12-6-11(17(21)22)16(20)14(13(10)12)18(23)24/h2-7,20H,1H3