2-[2-(2-tert-butyl-5-methyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)ethanoyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)acetyl]thiazole-4-carboxylic acid CAS Name: 2-[2-(2-tert-butyl-5-methylphenoxy)-1-oxoethyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-(2-tert-butyl-5-methylphenoxy)acetyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)acetyl]thiazole-4-carboxylic acid Formula: C17H19NO4S MolecularWeight: 333.40206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)C2=NC(=CS2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)C2=NC(=CS2)C(=O)O

InChI

InChI=1S/C17H19NO4S/c1-10-5-6-11(17(2,3)4)14(7-10)22-8-13(19)15-18-12(9-23-15)16(20)21/h5-7,9H,8H2,1-4H3,(H,20,21)