2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one

Systemtic Name: 2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one Openeye Name: 2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-benzofuran-4-one CAS Name: 2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-benzofuran-4-one IUPAC Name: 2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one Traditional Name: 2-nitro-3-(4-nitrophenyl)-3,5,6,7-tetrahydro-2H-benzofuran-4-one Formula: C14H12N2O6 MolecularWeight: 304.25488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(O2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(O2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C1

InChI

InChI=1S/C14H12N2O6/c17-10-2-1-3-11-13(10)12(14(22-11)16(20)21)8-4-6-9(7-5-8)15(18)19/h4-7,12,14H,1-3H2