2,2-diphosphonoethyl-icosyl-methyl-sulfanium

Systemtic Name: 2,2-diphosphonoethyl-icosyl-methyl-sulfanium Openeye Name: 2,2-diphosphonoethyl-icosyl-methyl-sulfonium CAS Name: 2,2-diphosphonoethyl-eicosyl-methylsulfonium IUPAC Name: 2,2-diphosphonoethyl-icosyl-methylsulfanium Traditional Name: arachyl-(2,2-diphosphonoethyl)-methyl-sulfonium Formula: C23H51O6P2S+ MolecularWeight: 517.659962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC[S+](C)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC[S+](C)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C23H50O6P2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(2)22-23(30(24,25)26)31(27,28)29/h23H,3-22H2,1-2H3,(H3-,24,25,26,27,28,29)/p+1