3-[4-(5-carboxy-2-ethyl-phenyl)buta-1,3-diynyl]-4-ethyl-benzoic acid

Systemtic Name: 3-[4-(5-carboxy-2-ethyl-phenyl)buta-1,3-diynyl]-4-ethyl-benzoic acid Openeye Name: 3-[4-(5-carboxy-2-ethyl-phenyl)buta-1,3-diynyl]-4-ethyl-benzoic acid CAS Name: 3-[4-(5-carboxy-2-ethylphenyl)buta-1,3-diynyl]-4-ethylbenzoic acid IUPAC Name: 3-[4-(5-carboxy-2-ethylphenyl)buta-1,3-diynyl]-4-ethylbenzoic acid Traditional Name: 3-[4-(5-carboxy-2-ethyl-phenyl)buta-1,3-diynyl]-4-ethyl-benzoic acid Formula: C22H18O4 MolecularWeight: 346.37592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)O)C#CC#CC2=C(C=CC(=C2)C(=O)O)CC

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)O)C#CC#CC2=C(C=CC(=C2)C(=O)O)CC

InChI

InChI=1S/C22H18O4/c1-3-15-9-11-19(21(23)24)13-17(15)7-5-6-8-18-14-20(22(25)26)12-10-16(18)4-2/h9-14H,3-4H2,1-2H3,(H,23,24)(H,25,26)