4-[[4-carboxylato-2,6-bis(oxidanyl)phenyl]methyl]-3,5-bis(oxidanyl)benzoate

Systemtic Name: 4-[[4-carboxylato-2,6-bis(oxidanyl)phenyl]methyl]-3,5-bis(oxidanyl)benzoate Openeye Name: 4-[(4-carboxylato-2,6-dihydroxy-phenyl)methyl]-3,5-dihydroxy-benzoate CAS Name: 4-[(4-carboxylato-2,6-dihydroxyphenyl)methyl]-3,5-dihydroxybenzoate IUPAC Name: 4-[(4-carboxylato-2,6-dihydroxyphenyl)methyl]-3,5-dihydroxybenzoate Traditional Name: 4-(4-carboxylato-2,6-dihydroxy-benzyl)-3,5-dihydroxy-benzoate Formula: C15H10O8-2 MolecularWeight: 318.2351

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1O)CC2=C(C=C(C=C2O)C(=O)[O-])O)O)C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1O)CC2=C(C=C(C=C2O)C(=O)[O-])O)O)C(=O)[O-]

InChI

InChI=1S/C15H12O8/c16-10-1-6(14(20)21)2-11(17)8(10)5-9-12(18)3-7(15(22)23)4-13(9)19/h1-4,16-19H,5H2,(H,20,21)(H,22,23)/p-2