2,2-diphosphonoethyl-methyl-tridecyl-sulfanium

Systemtic Name: 2,2-diphosphonoethyl-methyl-tridecyl-sulfanium Openeye Name: 2,2-diphosphonoethyl-methyl-tridecyl-sulfonium CAS Name: 2,2-diphosphonoethyl-methyl-tridecylsulfonium IUPAC Name: 2,2-diphosphonoethyl-methyl-tridecylsulfanium Traditional Name: 2,2-diphosphonoethyl-methyl-tridecyl-sulfonium Formula: C16H37O6P2S+ MolecularWeight: 419.473902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H36O6P2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-25(2)15-16(23(17,18)19)24(20,21)22/h16H,3-15H2,1-2H3,(H3-,17,18,19,20,21,22)/p+1