disodium (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) phosphate

Systemtic Name: disodium (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) phosphate Openeye Name: disodium (2-hexadecyl-2,5,7,8-tetramethyl-chroman-6-yl) phosphate CAS Name: disodium (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl) phosphate IUPAC Name: disodium (2-hexadecyl-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-yl) phosphate Traditional Name: disodium (2-cetyl-2,5,7,8-tetramethyl-chroman-6-yl) phosphate Formula: C29H49Na2O5P MolecularWeight: 554.649661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1(CCC2=C(C(=C(C(=C2O1)C)C)OP(=O)([O-])[O-])C)C.[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCC1(CCC2=C(C(=C(C(=C2O1)C)C)OP(=O)([O-])[O-])C)C.[Na+].[Na+]

InChI

InChI=1S/C29H51O5P.2Na/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-29(5)22-20-26-25(4)27(34-35(30,31)32)23(2)24(3)28(26)33-29;;/h6-22H2,1-5H3,(H2,30,31,32);;/q;2*+1/p-2