3-[(3-carboxy-2-oxidanyl-5-thiophen-2-yl-phenyl)methyl]-2-oxidanyl-5-thiophen-2-yl-benzoic acid

Systemtic Name: 3-[(3-carboxy-2-oxidanyl-5-thiophen-2-yl-phenyl)methyl]-2-oxidanyl-5-thiophen-2-yl-benzoic acid Openeye Name: 3-[[3-carboxy-2-hydroxy-5-(2-thienyl)phenyl]methyl]-2-hydroxy-5-(2-thienyl)benzoic acid CAS Name: 3-[(3-carboxy-2-hydroxy-5-thiophen-2-ylphenyl)methyl]-2-hydroxy-5-thiophen-2-ylbenzoic acid IUPAC Name: 3-[(3-carboxy-2-hydroxy-5-thiophen-2-ylphenyl)methyl]-2-hydroxy-5-thiophen-2-ylbenzoic acid Traditional Name: 3-[3-carboxy-2-hydroxy-5-(2-thienyl)benzyl]-2-hydroxy-5-(2-thienyl)benzoic acid Formula: C23H16O6S2 MolecularWeight: 452.49954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=C(C(=C2)CC3=CC(=CC(=C3O)C(=O)O)C4=CC=CS4)O)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC(=C(C(=C2)CC3=CC(=CC(=C3O)C(=O)O)C4=CC=CS4)O)C(=O)O

InChI

InChI=1S/C23H16O6S2/c24-20-14(7-12(10-16(20)22(26)27)18-3-1-5-30-18)9-15-8-13(19-4-2-6-31-19)11-17(21(15)25)23(28)29/h1-8,10-11,24-25H,9H2,(H,26,27)(H,28,29)