bis(2-oxidanylidenechromen-7-yl)iodanium; 4-methylbenzenesulfonate

Systemtic Name: bis(2-oxidanylidenechromen-7-yl)iodanium; 4-methylbenzenesulfonate Openeye Name: bis(2-oxochromen-7-yl)iodonium; 4-methylbenzenesulfonate CAS Name: bis(2-oxo-1-benzopyran-7-yl)iodonium; 4-methylbenzenesulfonate IUPAC Name: bis(2-oxochromen-7-yl)iodanium; 4-methylbenzenesulfonate Traditional Name: bis(2-ketochromen-7-yl)iodonium tosylate Formula: C25H17IO7S MolecularWeight: 588.36775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC(=CC2=C1C=CC(=O)O2)[I+]C3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC(=CC2=C1C=CC(=O)O2)[I+]C3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C18H10IO4.C7H8O3S/c20-17-7-3-11-1-5-13(9-15(11)22-17)19-14-6-2-12-4-8-18(21)23-16(12)10-14;1-6-2-4-7(5-3-6)11(8,9)10/h1-10H;2-5H,1H3,(H,8,9,10)/q+1;/p-1