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

Systemtic Name: 3-[2,3,5,6-tetramethyl-4-(3-phosphonopentan-3-yl)phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-[4-(1-ethyl-1-phosphono-propyl)-2,3,5,6-tetramethyl-phenyl]propyl]phosphonic acid CAS Name: 3-[2,3,5,6-tetramethyl-4-(3-phosphonopentan-3-yl)phenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[2,3,5,6-tetramethyl-4-(3-phosphonopentan-3-yl)phenyl]pentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-[4-(1-ethyl-1-phosphono-propyl)-2,3,5,6-tetramethyl-phenyl]propyl]phosphonic acid Formula: C20H36O6P2 MolecularWeight: 434.443762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(C(=C(C(=C1C)C)C(CC)(CC)P(=O)(O)O)C)C)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=C(C(=C(C(=C1C)C)C(CC)(CC)P(=O)(O)O)C)C)P(=O)(O)O

InChI

InChI=1S/C20H36O6P2/c1-9-19(10-2,27(21,22)23)17-13(5)15(7)18(16(8)14(17)6)20(11-3,12-4)28(24,25)26/h9-12H2,1-8H3,(H2,21,22,23)(H2,24,25,26)