[2-methyl-5-[3-(4-methyl-4-phosphonooxy-pentyl)sulfanylpropylsulfanyl]pentan-2-yl] dihydrogen phosphate

Systemtic Name: [2-methyl-5-[3-(4-methyl-4-phosphonooxy-pentyl)sulfanylpropylsulfanyl]pentan-2-yl] dihydrogen phosphate Openeye Name: [1,1-dimethyl-4-[3-(4-methyl-4-phosphonooxy-pentyl)sulfanylpropylsulfanyl]butyl] dihydrogen phosphate CAS Name: [2-methyl-5-[3-[(4-methyl-4-phosphonooxypentyl)thio]propylthio]pentan-2-yl] dihydrogen phosphate IUPAC Name: [2-methyl-5-[3-(4-methyl-4-phosphonooxypentyl)sulfanylpropylsulfanyl]pentan-2-yl] dihydrogen phosphate Traditional Name: [1,1-dimethyl-4-[3-[(4-methyl-4-phosphonooxy-pentyl)thio]propylthio]butyl] dihydrogen phosphate Formula: C15H34O8P2S2 MolecularWeight: 468.503182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCSCCCSCCCC(C)(C)OP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

CC(C)(CCCSCCCSCCCC(C)(C)OP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C15H34O8P2S2/c1-14(2,22-24(16,17)18)8-5-10-26-12-7-13-27-11-6-9-15(3,4)23-25(19,20)21/h5-13H2,1-4H3,(H2,16,17,18)(H2,19,20,21)