(2-methoxy-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl)-phenyl-iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2-methoxy-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl)-phenyl-iodanium; tris(fluoranyl)methanesulfonate Openeye Name: (6-methoxy-4-oxo-tetralin-5-yl)-phenyl-iodonium; trifluoromethanesulfonate CAS Name: (2-methoxy-8-oxo-6,7-dihydro-5H-naphthalen-1-yl)-phenyliodonium; trifluoromethanesulfonate IUPAC Name: (2-methoxy-8-oxo-6,7-dihydro-5H-naphthalen-1-yl)-phenyliodanium; trifluoromethanesulfonate Traditional Name: (4-keto-6-methoxy-tetralin-5-yl)-phenyl-iodonium triflate Formula: C18H16F3IO5S MolecularWeight: 528.28132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CCCC2=O)C=C1)[I+]C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C2=C(CCCC2=O)C=C1)[I+]C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H16IO2.CHF3O3S/c1-20-15-11-10-12-6-5-9-14(19)16(12)17(15)18-13-7-3-2-4-8-13;2-1(3,4)8(5,6)7/h2-4,7-8,10-11H,5-6,9H2,1H3;(H,5,6,7)/q+1;/p-1