(4-chloranyl-2-nitro-phenyl)iodanium; 2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate

Systemtic Name: (4-chloranyl-2-nitro-phenyl)iodanium; 2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate Openeye Name: (4-chloro-2-nitro-phenyl)iodonium; 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate CAS Name: (4-chloro-2-nitrophenyl)iodonium; 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate IUPAC Name: (4-chloro-2-nitrophenyl)iodanium; 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate Traditional Name: (4-chloro-2-nitro-phenyl)iodonium; 6-keto-2,2-dimethyl-1,3-dioxin-4-olate Formula: C12H11ClINO6 MolecularWeight: 427.57631

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=O)O1)[O-])C.C1=CC(=C(C=C1Cl)[N+](=O)[O-])[IH+]

Isomeric SMILES

CC1(OC(=CC(=O)O1)[O-])C.C1=CC(=C(C=C1Cl)[N+](=O)[O-])[IH+]

InChI

InChI=1S/C6H4ClINO2.C6H8O4/c7-4-1-2-5(8)6(3-4)9(10)11;1-6(2)9-4(7)3-5(8)10-6/h1-3,8H;3,7H,1-2H3/q+1;/p-1