(2,4,6-trimethyl-3-phosphonocarbonyl-phenyl)carbonylphosphonic acid

Systemtic Name: (2,4,6-trimethyl-3-phosphonocarbonyl-phenyl)carbonylphosphonic acid Openeye Name: (2,4,6-trimethyl-3-phosphonocarbonyl-benzoyl)phosphonic acid CAS Name: [oxo-[2,4,6-trimethyl-3-[oxo(phosphono)methyl]phenyl]methyl]phosphonic acid IUPAC Name: (2,4,6-trimethyl-3-phosphonocarbonylbenzoyl)phosphonic acid Traditional Name: (2,4,6-trimethyl-3-phosphonocarbonyl-benzoyl)phosphonic acid Formula: C11H14O8P2 MolecularWeight: 336.171582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O8P2/c1-5-4-6(2)9(11(13)21(17,18)19)7(3)8(5)10(12)20(14,15)16/h4H,1-3H3,(H2,14,15,16)(H2,17,18,19)