(2-ethoxycarbonylphenyl)-ethyl-octadecyl-sulfanium

Systemtic Name: (2-ethoxycarbonylphenyl)-ethyl-octadecyl-sulfanium Openeye Name: (2-ethoxycarbonylphenyl)-ethyl-octadecyl-sulfonium CAS Name: (2-ethoxycarbonylphenyl)-ethyl-octadecylsulfonium IUPAC Name: (2-ethoxycarbonylphenyl)-ethyl-octadecylsulfanium Traditional Name: (2-carbethoxyphenyl)-ethyl-stearyl-sulfonium Formula: C29H51O2S+ MolecularWeight: 463.77904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[S+](CC)C1=CC=CC=C1C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[S+](CC)C1=CC=CC=C1C(=O)OCC

InChI

InChI=1S/C29H51O2S/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-26-32(6-3)28-25-22-21-24-27(28)29(30)31-5-2/h21-22,24-25H,4-20,23,26H2,1-3H3/q+1