4-[3-(4-carboxyphenoxy)-2-ethynyl-phenoxy]benzoic acid

Systemtic Name: 4-[3-(4-carboxyphenoxy)-2-ethynyl-phenoxy]benzoic acid Openeye Name: 4-[3-(4-carboxyphenoxy)-2-ethynyl-phenoxy]benzoic acid CAS Name: 4-[3-(4-carboxyphenoxy)-2-ethynylphenoxy]benzoic acid IUPAC Name: 4-[3-(4-carboxyphenoxy)-2-ethynylphenoxy]benzoic acid Traditional Name: 4-[3-(4-carboxyphenoxy)-2-ethynyl-phenoxy]benzoic acid Formula: C22H14O6 MolecularWeight: 374.34296

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=CC=C1OC2=CC=C(C=C2)C(=O)O)OC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C#CC1=C(C=CC=C1OC2=CC=C(C=C2)C(=O)O)OC3=CC=C(C=C3)C(=O)O

InChI

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