bis(4-methylphenyl)iodanium; pyrene-1-sulfonate

Systemtic Name: bis(4-methylphenyl)iodanium; pyrene-1-sulfonate Openeye Name: bis-p-tolyliodonium; pyrene-1-sulfonate CAS Name: bis(4-methylphenyl)iodonium; 1-pyrenesulfonate IUPAC Name: bis(4-methylphenyl)iodanium; pyrene-1-sulfonate Traditional Name: bis-p-tolyliodonium; pyrene-1-sulfonate Formula: C30H23IO3S MolecularWeight: 590.47129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C.C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C.C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C16H10O3S.C14H14I/c17-20(18,19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h1-9H,(H,17,18,19);3-10H,1-2H3/q;+1/p-1