5-[2-(2-chlorophenyl)ethynyl]furan-2-carboxylic acid

Systemtic Name: 5-[2-(2-chlorophenyl)ethynyl]furan-2-carboxylic acid Openeye Name: 5-[2-(2-chlorophenyl)ethynyl]furan-2-carboxylic acid CAS Name: 5-[2-(2-chlorophenyl)ethynyl]-2-furancarboxylic acid IUPAC Name: 5-[2-(2-chlorophenyl)ethynyl]furan-2-carboxylic acid Traditional Name: 5-[2-(2-chlorophenyl)ethynyl]-2-furoic acid Formula: C13H7ClO3 MolecularWeight: 246.64588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7ClO3/c14-11-4-2-1-3-9(11)5-6-10-7-8-12(17-10)13(15)16/h1-4,7-8H,(H,15,16)