iodanylbenzene; (4-methoxyphenyl) 2-dodecylbenzenesulfonate

Systemtic Name: iodanylbenzene; (4-methoxyphenyl) 2-dodecylbenzenesulfonate Openeye Name: iodobenzene; (4-methoxyphenyl) 2-dodecylbenzenesulfonate CAS Name: 2-dodecylbenzenesulfonic acid (4-methoxyphenyl) ester; iodobenzene IUPAC Name: iodobenzene; (4-methoxyphenyl) 2-dodecylbenzenesulfonate Traditional Name: iodobenzene; 2-laurylbenzenesulfonic acid (4-methoxyphenyl) ester Formula: C31H41IO4S MolecularWeight: 636.62431

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)OC2=CC=C(C=C2)OC.C1=CC=C(C=C1)I

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)OC2=CC=C(C=C2)OC.C1=CC=C(C=C1)I

InChI

InChI=1S/C25H36O4S.C6H5I/c1-3-4-5-6-7-8-9-10-11-12-15-22-16-13-14-17-25(22)30(26,27)29-24-20-18-23(28-2)19-21-24;7-6-4-2-1-3-5-6/h13-14,16-21H,3-12,15H2,1-2H3;1-5H