diphenyliodanium; 8-phenylazanylnaphthalene-1-sulfonate

Systemtic Name: diphenyliodanium; 8-phenylazanylnaphthalene-1-sulfonate Openeye Name: 8-anilinonaphthalene-1-sulfonate; diphenyliodonium CAS Name: 8-anilino-1-naphthalenesulfonate; diphenyliodonium IUPAC Name: 8-anilinonaphthalene-1-sulfonate; diphenyliodanium Traditional Name: 8-anilinonaphthalene-1-sulfonate; diphenyliodonium Formula: C28H22INO3S MolecularWeight: 579.44865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-].C1=CC=C(C=C1)[I+]C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-].C1=CC=C(C=C1)[I+]C2=CC=CC=C2

InChI

InChI=1S/C16H13NO3S.C12H10I/c18-21(19,20)15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-11,17H,(H,18,19,20);1-10H/q;+1/p-1