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

Systemtic Name: 3-[4-(3-carboxy-5-methyl-phenyl)buta-1,3-diynyl]-5-methyl-benzoic acid Openeye Name: 3-[4-(3-carboxy-5-methyl-phenyl)buta-1,3-diynyl]-5-methyl-benzoic acid CAS Name: 3-[4-(3-carboxy-5-methylphenyl)buta-1,3-diynyl]-5-methylbenzoic acid IUPAC Name: 3-[4-(3-carboxy-5-methylphenyl)buta-1,3-diynyl]-5-methylbenzoic acid Traditional Name: 3-[4-(3-carboxy-5-methyl-phenyl)buta-1,3-diynyl]-5-methyl-benzoic acid Formula: C20H14O4 MolecularWeight: 318.32276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)O)C#CC#CC2=CC(=CC(=C2)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)O)C#CC#CC2=CC(=CC(=C2)C)C(=O)O

InChI

InChI=1S/C20H14O4/c1-13-7-15(11-17(9-13)19(21)22)5-3-4-6-16-8-14(2)10-18(12-16)20(23)24/h7-12H,1-2H3,(H,21,22)(H,23,24)