2-[2,4,6-trimethyl-3-(2-phosphonopropan-2-yl)phenyl]propan-2-ylphosphonic acid

Systemtic Name: 2-[2,4,6-trimethyl-3-(2-phosphonopropan-2-yl)phenyl]propan-2-ylphosphonic acid Openeye Name: [1-methyl-1-[2,4,6-trimethyl-3-(1-methyl-1-phosphono-ethyl)phenyl]ethyl]phosphonic acid CAS Name: 2-[2,4,6-trimethyl-3-(2-phosphonopropan-2-yl)phenyl]propan-2-ylphosphonic acid IUPAC Name: 2-[2,4,6-trimethyl-3-(2-phosphonopropan-2-yl)phenyl]propan-2-ylphosphonic acid Traditional Name: [1-methyl-1-[2,4,6-trimethyl-3-(1-methyl-1-phosphono-ethyl)phenyl]ethyl]phosphonic acid Formula: C15H26O6P2 MolecularWeight: 364.310862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(C)(C)P(=O)(O)O)C)C(C)(C)P(=O)(O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(C)(C)P(=O)(O)O)C)C(C)(C)P(=O)(O)O)C

InChI

InChI=1S/C15H26O6P2/c1-9-8-10(2)13(15(6,7)23(19,20)21)11(3)12(9)14(4,5)22(16,17)18/h8H,1-7H3,(H2,16,17,18)(H2,19,20,21)