4-[2-(2-oxidanylidene-2-phenylmethoxy-ethoxy)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoic acid

Systemtic Name: 4-[2-(2-oxidanylidene-2-phenylmethoxy-ethoxy)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoic acid Openeye Name: 3,5-dibenzyloxy-4-[2-benzyloxy-6-(2-benzyloxy-2-oxo-ethoxy)benzoyl]benzoic acid CAS Name: 4-[oxo-[2-(2-oxo-2-phenylmethoxyethoxy)-6-phenylmethoxyphenyl]methyl]-3,5-bis(phenylmethoxy)benzoic acid IUPAC Name: 4-[2-(2-oxo-2-phenylmethoxyethoxy)-6-phenylmethoxybenzoyl]-3,5-bis(phenylmethoxy)benzoic acid Traditional Name: 3,5-dibenzoxy-4-[2-benzoxy-6-(2-benzoxy-2-keto-ethoxy)benzoyl]benzoic acid Formula: C44H36O9 MolecularWeight: 708.75124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=CC=C2)OCC(=O)OCC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4OCC5=CC=CC=C5)C(=O)O)OCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=CC=C2)OCC(=O)OCC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4OCC5=CC=CC=C5)C(=O)O)OCC6=CC=CC=C6

InChI

InChI=1S/C44H36O9/c45-40(53-29-34-20-11-4-12-21-34)30-52-37-23-13-22-36(49-26-31-14-5-1-6-15-31)41(37)43(46)42-38(50-27-32-16-7-2-8-17-32)24-35(44(47)48)25-39(42)51-28-33-18-9-3-10-19-33/h1-25H,26-30H2,(H,47,48)