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dinaphthalen-1-yliodanium; 4-methylbenzenesulfonate

dinaphthalen-1-yliodanium; 4-methylbenzenesulfonate

Systemtic Name:dinaphthalen-1-yliodanium; 4-methylbenzenesulfonate
Openeye Name:bis(1-naphthyl)iodonium; 4-methylbenzenesulfonate
CAS Name:bis(1-naphthalenyl)iodonium; 4-methylbenzenesulfonate
IUPAC Name:dinaphthalen-1-yliodanium; 4-methylbenzenesulfonate
Traditional Name:bis(1-naphthyl)iodonium tosylate
Formula: C27H21IO3S
MolecularWeight: 552.42331
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC=C2[I+]C3=CC=CC4=CC=CC=C43


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC=C2[I+]C3=CC=CC4=CC=CC=C43


InChI

InChI=1S/C20H14I.C7H8O3S/c1-3-11-17-15(7-1)9-5-13-19(17)21-20-14-6-10-16-8-2-4-12-18(16)20;1-6-2-4-7(5-3-6)11(8,9)10/h1-14H;2-5H,1H3,(H,8,9,10)/q+1;/p-1


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