methylsulfanyl (2-methylsulfanyl-4-octyl-phenyl) phosphate

Systemtic Name: methylsulfanyl (2-methylsulfanyl-4-octyl-phenyl) phosphate Openeye Name: methylsulfanyl (2-methylsulfanyl-4-octyl-phenyl) phosphate CAS Name: (methylthio) [2-(methylthio)-4-octylphenyl] phosphate IUPAC Name: methylsulfanyl (2-methylsulfanyl-4-octylphenyl) phosphate Traditional Name: (methylthio) [2-(methylthio)-4-octyl-phenyl] phosphate Formula: C16H26O4PS2- MolecularWeight: 377.479001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)OP(=O)([O-])OSC)SC

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)OP(=O)([O-])OSC)SC

InChI

InChI=1S/C16H27O4PS2/c1-4-5-6-7-8-9-10-14-11-12-15(16(13-14)22-2)19-21(17,18)20-23-3/h11-13H,4-10H2,1-3H3,(H,17,18)/p-1