4-octylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium

Systemtic Name: 4-octylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium Openeye Name: 4-octylbenzenesulfonate; tris(4-methoxyphenyl)sulfonium CAS Name: 4-octylbenzenesulfonate; tris(4-methoxyphenyl)sulfonium IUPAC Name: 4-octylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium Traditional Name: 4-octylbesylate; tris(4-methoxyphenyl)sulfonium Formula: C35H42O6S2 MolecularWeight: 622.83438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21O3S.C14H22O3S/c1-22-16-4-10-19(11-5-16)25(20-12-6-17(23-2)7-13-20)21-14-8-18(24-3)9-15-21;1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)18(15,16)17/h4-15H,1-3H3;9-12H,2-8H2,1H3,(H,15,16,17)/q+1;/p-1