2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-oxidanyl-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-oxidanyl-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-hydroxy-2-oxo-ethyl]benzoic acid CAS Name: 2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-hydroxy-2-oxoethyl]benzoic acid IUPAC Name: 2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-hydroxy-2-oxoethyl]benzoic acid Traditional Name: 2-[1-[2-(carboxymethyloxy)ethoxy]-1-(2-carboxyphenyl)-2-hydroxy-2-keto-ethyl]benzoic acid Formula: C20H18O10 MolecularWeight: 418.35092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)C(C2=CC=CC=C2C(=O)O)(C(=O)O)OCCOCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)C(C2=CC=CC=C2C(=O)O)(C(=O)O)OCCOCC(=O)O

InChI

InChI=1S/C20H18O10/c21-16(22)11-29-9-10-30-20(19(27)28,14-7-3-1-5-12(14)17(23)24)15-8-4-2-6-13(15)18(25)26/h1-8H,9-11H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)