tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphonatooxy-3,4-dihydrochromen-2-yl)dodecyl phosphate

Systemtic Name: tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphonatooxy-3,4-dihydrochromen-2-yl)dodecyl phosphate Openeye Name: tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphonatooxy-chroman-2-yl)dodecyl phosphate CAS Name: tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphonatooxy-3,4-dihydro-2H-1-benzopyran-2-yl)dodecyl phosphate IUPAC Name: tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphonatooxy-3,4-dihydrochromen-2-yl)dodecyl phosphate Traditional Name: tetrasodium 12-(2,5,7,8-tetramethyl-6-phosphato-chroman-2-yl)dodecyl phosphate Formula: C25H40Na4O9P2 MolecularWeight: 638.486302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OP(=O)([O-])[O-])C)CCC(O2)(C)CCCCCCCCCCCCOP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OP(=O)([O-])[O-])C)CCC(O2)(C)CCCCCCCCCCCCOP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C25H44O9P2.4Na/c1-19-20(2)24-22(21(3)23(19)34-36(29,30)31)15-17-25(4,33-24)16-13-11-9-7-5-6-8-10-12-14-18-32-35(26,27)28;;;;/h5-18H2,1-4H3,(H2,26,27,28)(H2,29,30,31);;;;/q;4*+1/p-4