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

Systemtic Name: propane-1-sulfonate; tris(4-methylphenyl)sulfanium Openeye Name: propane-1-sulfonate; tris-p-tolylsulfonium CAS Name: 1-propanesulfonate; tris(4-methylphenyl)sulfonium IUPAC Name: propane-1-sulfonate; tris(4-methylphenyl)sulfanium Traditional Name: propane-1-sulfonate; tris-p-tolylsulfonium Formula: C24H28O3S2 MolecularWeight: 428.60732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCS(=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.C3H8O3S/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;1-2-3-7(4,5)6/h4-15H,1-3H3;2-3H2,1H3,(H,4,5,6)/q+1;/p-1