4-[3,5-bis[(4-carboxy-3-chloranyl-phenoxy)carbonyl]phenyl]carbonyloxy-2-chloranyl-benzoic acid

Systemtic Name: 4-[3,5-bis[(4-carboxy-3-chloranyl-phenoxy)carbonyl]phenyl]carbonyloxy-2-chloranyl-benzoic acid Openeye Name: 4-[3,5-bis[(4-carboxy-3-chloro-phenoxy)carbonyl]benzoyl]oxy-2-chloro-benzoic acid CAS Name: 4-[[3,5-bis[(4-carboxy-3-chlorophenoxy)-oxomethyl]phenyl]-oxomethoxy]-2-chlorobenzoic acid IUPAC Name: 4-[3,5-bis[(4-carboxy-3-chlorophenoxy)carbonyl]benzoyl]oxy-2-chlorobenzoic acid Traditional Name: 4-[3,5-bis[(4-carboxy-3-chloro-phenoxy)carbonyl]benzoyl]oxy-2-chloro-benzoic acid Formula: C30H15Cl3O12 MolecularWeight: 673.7919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC(=O)C2=CC(=CC(=C2)C(=O)OC3=CC(=C(C=C3)C(=O)O)Cl)C(=O)OC4=CC(=C(C=C4)C(=O)O)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1OC(=O)C2=CC(=CC(=C2)C(=O)OC3=CC(=C(C=C3)C(=O)O)Cl)C(=O)OC4=CC(=C(C=C4)C(=O)O)Cl)Cl)C(=O)O

InChI

InChI=1S/C30H15Cl3O12/c31-22-10-16(1-4-19(22)25(34)35)43-28(40)13-7-14(29(41)44-17-2-5-20(26(36)37)23(32)11-17)9-15(8-13)30(42)45-18-3-6-21(27(38)39)24(33)12-18/h1-12H,(H,34,35)(H,36,37)(H,38,39)