octane-1-sulfonate; tris(4-methylphenyl)sulfanium

Systemtic Name: octane-1-sulfonate; tris(4-methylphenyl)sulfanium Openeye Name: octane-1-sulfonate; tris-p-tolylsulfonium CAS Name: 1-octanesulfonate; tris(4-methylphenyl)sulfonium IUPAC Name: octane-1-sulfonate; tris(4-methylphenyl)sulfanium Traditional Name: octane-1-sulfonate; tris-p-tolylsulfonium Formula: C157H310O51S18-16 MolecularWeight: 3591.2807

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CCCCCCCCS(=O)(=O)[O-].CC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21S.17C8H18O3S/c1-16-4-10-19(11-5-16)22(20-12-6-17(2)7-13-20)21-14-8-18(3)9-15-21;17*1-2-3-4-5-6-7-8-12(9,10)11/h4-15H,1-3H3;17*2-8H2,1H3,(H,9,10,11)/q+1;;;;;;;;;;;;;;;;;/p-17