[4-oxidanyl-3-[4-(2-phosphonoethyl)phenyl]carbonyl-phenyl]phosphonic acid

Systemtic Name: [4-oxidanyl-3-[4-(2-phosphonoethyl)phenyl]carbonyl-phenyl]phosphonic acid Openeye Name: 2-[4-(2-hydroxy-5-phosphono-benzoyl)phenyl]ethylphosphonic acid CAS Name: [4-hydroxy-3-[oxo-[4-(2-phosphonoethyl)phenyl]methyl]phenyl]phosphonic acid IUPAC Name: 2-[4-(2-hydroxy-5-phosphonobenzoyl)phenyl]ethylphosphonic acid Traditional Name: 2-[4-(2-hydroxy-5-phosphono-benzoyl)phenyl]ethylphosphonic acid Formula: C15H16O8P2 MolecularWeight: 386.230262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCP(=O)(O)O)C(=O)C2=C(C=CC(=C2)P(=O)(O)O)O

Isomeric SMILES

C1=CC(=CC=C1CCP(=O)(O)O)C(=O)C2=C(C=CC(=C2)P(=O)(O)O)O

InChI

InChI=1S/C15H16O8P2/c16-14-6-5-12(25(21,22)23)9-13(14)15(17)11-3-1-10(2-4-11)7-8-24(18,19)20/h1-6,9,16H,7-8H2,(H2,18,19,20)(H2,21,22,23)