5-[2,3,5,6-tetramethyl-4-(5-phosphonononan-5-yl)phenyl]nonan-5-ylphosphonic acid

Systemtic Name: 5-[2,3,5,6-tetramethyl-4-(5-phosphonononan-5-yl)phenyl]nonan-5-ylphosphonic acid Openeye Name: [1-butyl-1-[4-(1-butyl-1-phosphono-pentyl)-2,3,5,6-tetramethyl-phenyl]pentyl]phosphonic acid CAS Name: 5-[2,3,5,6-tetramethyl-4-(5-phosphonononan-5-yl)phenyl]nonan-5-ylphosphonic acid IUPAC Name: 5-[2,3,5,6-tetramethyl-4-(5-phosphonononan-5-yl)phenyl]nonan-5-ylphosphonic acid Traditional Name: [1-butyl-1-[4-(1-butyl-1-phosphono-pentyl)-2,3,5,6-tetramethyl-phenyl]pentyl]phosphonic acid Formula: C28H52O6P2 MolecularWeight: 546.656402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C1=C(C(=C(C(=C1C)C)C(CCCC)(CCCC)P(=O)(O)O)C)C)P(=O)(O)O

Isomeric SMILES

CCCCC(CCCC)(C1=C(C(=C(C(=C1C)C)C(CCCC)(CCCC)P(=O)(O)O)C)C)P(=O)(O)O

InChI

InChI=1S/C28H52O6P2/c1-9-13-17-27(18-14-10-2,35(29,30)31)25-21(5)23(7)26(24(8)22(25)6)28(19-15-11-3,20-16-12-4)36(32,33)34/h9-20H2,1-8H3,(H2,29,30,31)(H2,32,33,34)