5-[2-(4-methylphenyl)ethynyl]furan-2-carboxylic acid

Systemtic Name: 5-[2-(4-methylphenyl)ethynyl]furan-2-carboxylic acid Openeye Name: 5-[2-(p-tolyl)ethynyl]furan-2-carboxylic acid CAS Name: 5-[2-(4-methylphenyl)ethynyl]-2-furancarboxylic acid IUPAC Name: 5-[2-(4-methylphenyl)ethynyl]furan-2-carboxylic acid Traditional Name: 5-[2-(p-tolyl)ethynyl]-2-furoic acid Formula: C14H10O3 MolecularWeight: 226.2274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C14H10O3/c1-10-2-4-11(5-3-10)6-7-12-8-9-13(17-12)14(15)16/h2-5,8-9H,1H3,(H,15,16)