[2-methyl-6-(5-methyl-5-phosphonooxy-hexyl)sulfanyl-hexan-2-yl] dihydrogen phosphate

Systemtic Name: [2-methyl-6-(5-methyl-5-phosphonooxy-hexyl)sulfanyl-hexan-2-yl] dihydrogen phosphate Openeye Name: [1,1-dimethyl-5-(5-methyl-5-phosphonooxy-hexyl)sulfanyl-pentyl] dihydrogen phosphate CAS Name: [2-methyl-6-[(5-methyl-5-phosphonooxyhexyl)thio]hexan-2-yl] dihydrogen phosphate IUPAC Name: [2-methyl-6-(5-methyl-5-phosphonooxyhexyl)sulfanylhexan-2-yl] dihydrogen phosphate Traditional Name: [1,1-dimethyl-5-[(5-methyl-5-phosphonooxy-hexyl)thio]pentyl] dihydrogen phosphate Formula: C14H32O8P2S MolecularWeight: 422.411602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCSCCCCC(C)(C)OP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

CC(C)(CCCCSCCCCC(C)(C)OP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C14H32O8P2S/c1-13(2,21-23(15,16)17)9-5-7-11-25-12-8-6-10-14(3,4)22-24(18,19)20/h5-12H2,1-4H3,(H2,15,16,17)(H2,18,19,20)