2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]thiazole-4-carboxylic acid CAS Name: 2-[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]thiazole-4-carboxylic acid Formula: C14H12ClNO4S MolecularWeight: 325.76738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)C2=NC(=CS2)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)C2=NC(=CS2)C(=O)O

InChI

InChI=1S/C14H12ClNO4S/c1-7-3-9(4-8(2)12(7)15)20-5-11(17)13-16-10(6-21-13)14(18)19/h3-4,6H,5H2,1-2H3,(H,18,19)