4-[3-(4-carboxyphenoxy)-5-ethynyl-phenoxy]benzoic acid

Systemtic Name: 4-[3-(4-carboxyphenoxy)-5-ethynyl-phenoxy]benzoic acid Openeye Name: 4-[3-(4-carboxyphenoxy)-5-ethynyl-phenoxy]benzoic acid CAS Name: 4-[3-(4-carboxyphenoxy)-5-ethynylphenoxy]benzoic acid IUPAC Name: 4-[3-(4-carboxyphenoxy)-5-ethynylphenoxy]benzoic acid Traditional Name: 4-[3-(4-carboxyphenoxy)-5-ethynyl-phenoxy]benzoic acid Formula: C22H14O6 MolecularWeight: 374.34296

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)O)OC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C#CC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)O)OC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H14O6/c1-2-14-11-19(27-17-7-3-15(4-8-17)21(23)24)13-20(12-14)28-18-9-5-16(6-10-18)22(25)26/h1,3-13H,(H,23,24)(H,25,26)