[2-phenyl-7-(6-phenyl-6-phosphonooxy-heptyl)sulfanyl-heptan-2-yl] dihydrogen phosphate

Systemtic Name: [2-phenyl-7-(6-phenyl-6-phosphonooxy-heptyl)sulfanyl-heptan-2-yl] dihydrogen phosphate Openeye Name: [1-methyl-1-phenyl-6-(6-phenyl-6-phosphonooxy-heptyl)sulfanyl-hexyl] dihydrogen phosphate CAS Name: [2-phenyl-7-[(6-phenyl-6-phosphonooxyheptyl)thio]heptan-2-yl] dihydrogen phosphate IUPAC Name: [2-phenyl-7-(6-phenyl-6-phosphonooxyheptyl)sulfanylheptan-2-yl] dihydrogen phosphate Traditional Name: [1-methyl-1-phenyl-6-[(6-phenyl-6-phosphonooxy-heptyl)thio]hexyl] dihydrogen phosphate Formula: C26H40O8P2S MolecularWeight: 574.603522

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCSCCCCCC(C)(C1=CC=CC=C1)OP(=O)(O)O)(C2=CC=CC=C2)OP(=O)(O)O

Isomeric SMILES

CC(CCCCCSCCCCCC(C)(C1=CC=CC=C1)OP(=O)(O)O)(C2=CC=CC=C2)OP(=O)(O)O

InChI

InChI=1S/C26H40O8P2S/c1-25(33-35(27,28)29,23-15-7-3-8-16-23)19-11-5-13-21-37-22-14-6-12-20-26(2,34-36(30,31)32)24-17-9-4-10-18-24/h3-4,7-10,15-18H,5-6,11-14,19-22H2,1-2H3,(H2,27,28,29)(H2,30,31,32)