[(2-dodecylphenoxy)-phenyl-methyl]-dimethyl-sulfanium chloride

Systemtic Name: [(2-dodecylphenoxy)-phenyl-methyl]-dimethyl-sulfanium chloride Openeye Name: [(2-dodecylphenoxy)-phenyl-methyl]-dimethyl-sulfonium chloride CAS Name: [(2-dodecylphenoxy)-phenylmethyl]-dimethylsulfonium chloride IUPAC Name: [(2-dodecylphenoxy)-phenylmethyl]-dimethylsulfanium chloride Traditional Name: [(2-laurylphenoxy)-phenyl-methyl]-dimethyl-sulfonium chloride Formula: C27H41ClOS MolecularWeight: 449.13184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1OC(C2=CC=CC=C2)[S+](C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1OC(C2=CC=CC=C2)[S+](C)C.[Cl-]

InChI

InChI=1S/C27H41OS.ClH/c1-4-5-6-7-8-9-10-11-12-14-19-24-20-17-18-23-26(24)28-27(29(2)3)25-21-15-13-16-22-25;/h13,15-18,20-23,27H,4-12,14,19H2,1-3H3;1H/q+1;/p-1