2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate; (2-nitrophenyl)iodanium

Systemtic Name: 2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate; (2-nitrophenyl)iodanium Openeye Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; (2-nitrophenyl)iodonium CAS Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; (2-nitrophenyl)iodonium IUPAC Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; (2-nitrophenyl)iodanium Traditional Name: 6-keto-2,2-dimethyl-1,3-dioxin-4-olate; (2-nitrophenyl)iodonium Formula: C12H12INO6 MolecularWeight: 393.13125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=O)O1)[O-])C.C1=CC=C(C(=C1)[N+](=O)[O-])[IH+]

Isomeric SMILES

CC1(OC(=CC(=O)O1)[O-])C.C1=CC=C(C(=C1)[N+](=O)[O-])[IH+]

InChI

InChI=1S/C6H5INO2.C6H8O4/c7-5-3-1-2-4-6(5)8(9)10;1-6(2)9-4(7)3-5(8)10-6/h1-4,7H;3,7H,1-2H3/q+1;/p-1