2-[(2,5-dicarboxyphenyl)-oxidanyl-phosphoryl]terephthalic acid

Systemtic Name: 2-[(2,5-dicarboxyphenyl)-oxidanyl-phosphoryl]terephthalic acid Openeye Name: 2-[(2,5-dicarboxyphenyl)-hydroxy-phosphoryl]terephthalic acid CAS Name: 2-[(2,5-dicarboxyphenyl)-hydroxyphosphoryl]terephthalic acid IUPAC Name: 2-[(2,5-dicarboxyphenyl)-hydroxyphosphoryl]terephthalic acid Traditional Name: 2-[(2,5-dicarboxyphenyl)-hydroxy-phosphoryl]terephthalic acid Formula: C16H11O10P MolecularWeight: 394.226301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)P(=O)(C2=C(C=CC(=C2)C(=O)O)C(=O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)P(=O)(C2=C(C=CC(=C2)C(=O)O)C(=O)O)O)C(=O)O

InChI

InChI=1S/C16H11O10P/c17-13(18)7-1-3-9(15(21)22)11(5-7)27(25,26)12-6-8(14(19)20)2-4-10(12)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)(H,25,26)