4-[3-[2,3-bis[(4-carboxylatophenyl)carbonyloxy]phenoxy]-2-(4-carboxyphenyl)carbonyloxy-phenoxy]carbonylbenzoate

Systemtic Name: 4-[3-[2,3-bis[(4-carboxylatophenyl)carbonyloxy]phenoxy]-2-(4-carboxyphenyl)carbonyloxy-phenoxy]carbonylbenzoate Openeye Name: 4-[3-[2,3-bis[(4-carboxylatobenzoyl)oxy]phenoxy]-2-(4-carboxybenzoyl)oxy-phenoxy]carbonylbenzoate CAS Name: 4-[[3-[2,3-bis[(4-carboxylatophenyl)-oxomethoxy]phenoxy]-2-[(4-carboxyphenyl)-oxomethoxy]phenoxy]-oxomethyl]benzoate IUPAC Name: 4-[3-[2,3-bis[(4-carboxylatobenzoyl)oxy]phenoxy]-2-(4-carboxybenzoyl)oxyphenoxy]carbonylbenzoate Traditional Name: 4-[3-[2,3-bis[(4-carboxylatobenzoyl)oxy]phenoxy]-2-(4-carboxybenzoyl)oxy-phenoxy]carbonylbenzoate Formula: C44H23O17-3 MolecularWeight: 823.64322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC(=O)C2=CC=C(C=C2)C(=O)[O-])OC(=O)C3=CC=C(C=C3)C(=O)O)OC4=C(C(=CC=C4)OC(=O)C5=CC=C(C=C5)C(=O)[O-])OC(=O)C6=CC=C(C=C6)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)OC(=O)C2=CC=C(C=C2)C(=O)[O-])OC(=O)C3=CC=C(C=C3)C(=O)O)OC4=C(C(=CC=C4)OC(=O)C5=CC=C(C=C5)C(=O)[O-])OC(=O)C6=CC=C(C=C6)C(=O)[O-]

InChI

InChI=1S/C44H26O17/c45-37(46)23-7-15-27(16-8-23)41(53)58-33-5-1-3-31(35(33)60-43(55)29-19-11-25(12-20-29)39(49)50)57-32-4-2-6-34(59-42(54)28-17-9-24(10-18-28)38(47)48)36(32)61-44(56)30-21-13-26(14-22-30)40(51)52/h1-22H,(H,45,46)(H,47,48)(H,49,50)(H,51,52)/p-3