[4,4-dimethyl-8-(5-methyl-5-phosphonooxy-hexoxy)octyl] dihydrogen phosphate

Systemtic Name: [4,4-dimethyl-8-(5-methyl-5-phosphonooxy-hexoxy)octyl] dihydrogen phosphate Openeye Name: [4,4-dimethyl-8-(5-methyl-5-phosphonooxy-hexoxy)octyl] dihydrogen phosphate CAS Name: [4,4-dimethyl-8-(5-methyl-5-phosphonooxyhexoxy)octyl] dihydrogen phosphate IUPAC Name: [4,4-dimethyl-8-(5-methyl-5-phosphonooxyhexoxy)octyl] dihydrogen phosphate Traditional Name: [4,4-dimethyl-8-(5-methyl-5-phosphonooxy-hexoxy)octyl] dihydrogen phosphate Formula: C17H38O9P2 MolecularWeight: 448.425742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOCCCCC(C)(C)OP(=O)(O)O)CCCOP(=O)(O)O

Isomeric SMILES

CC(C)(CCCCOCCCCC(C)(C)OP(=O)(O)O)CCCOP(=O)(O)O

InChI

InChI=1S/C17H38O9P2/c1-16(2,11-9-15-25-27(18,19)20)10-5-7-13-24-14-8-6-12-17(3,4)26-28(21,22)23/h5-15H2,1-4H3,(H2,18,19,20)(H2,21,22,23)