2-[2-(3,4,5-trimethoxyphenyl)ethynyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-(3,4,5-trimethoxyphenyl)ethynyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-(3,4,5-trimethoxyphenyl)ethynyl]thiazole-4-carboxylic acid CAS Name: 2-[2-(3,4,5-trimethoxyphenyl)ethynyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-(3,4,5-trimethoxyphenyl)ethynyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-(3,4,5-trimethoxyphenyl)ethynyl]thiazole-4-carboxylic acid Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C#CC2=NC(=CS2)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C#CC2=NC(=CS2)C(=O)O

InChI

InChI=1S/C15H13NO5S/c1-19-11-6-9(7-12(20-2)14(11)21-3)4-5-13-16-10(8-22-13)15(17)18/h6-8H,1-3H3,(H,17,18)