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4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid

4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid

Systemtic Name:4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid
Openeye Name:4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid
CAS Name:4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid
IUPAC Name:4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid
Traditional Name:4-[bis(4-carboxyphenyl)-(4-iodophenyl)methyl]benzoic acid
Formula: C28H19IO6
MolecularWeight: 578.35133
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)C(C2=CC=C(C=C2)C(=O)O)(C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)I


Isomeric SMILES

C1=CC(=CC=C1C(=O)O)C(C2=CC=C(C=C2)C(=O)O)(C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)I


InChI

InChI=1S/C28H19IO6/c29-24-15-13-23(14-16-24)28(20-7-1-17(2-8-20)25(30)31,21-9-3-18(4-10-21)26(32)33)22-11-5-19(6-12-22)27(34)35/h1-16H,(H,30,31)(H,32,33)(H,34,35)


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