5,5-dimethyl-2-(2-nitrophenyl)iodonio-3-oxidanylidene-cyclohexen-1-olate

Systemtic Name: 5,5-dimethyl-2-(2-nitrophenyl)iodonio-3-oxidanylidene-cyclohexen-1-olate Openeye Name: 5,5-dimethyl-2-(2-nitrophenyl)iodonio-3-oxo-cyclohexen-1-olate CAS Name: 5,5-dimethyl-2-(2-nitrophenyl)iodonio-3-oxo-1-cyclohexenolate IUPAC Name: 5,5-dimethyl-2-(2-nitrophenyl)iodonio-3-oxocyclohexen-1-olate Traditional Name: 3-keto-5,5-dimethyl-2-(2-nitrophenyl)iodonio-cyclohexen-1-olate Formula: C14H14INO4 MolecularWeight: 387.16973

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)[I+]C2=CC=CC=C2[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)[I+]C2=CC=CC=C2[N+](=O)[O-])[O-])C

InChI

InChI=1S/C14H14INO4/c1-14(2)7-11(17)13(12(18)8-14)15-9-5-3-4-6-10(9)16(19)20/h3-6H,7-8H2,1-2H3