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

Systemtic Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)ethanoyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)acetyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-(2-tert-butyl-5-methylphenoxy)-1-oxoethyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-(2-tert-butyl-5-methylphenoxy)acetyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-(2-tert-butyl-5-methyl-phenoxy)acetyl]-4-methyl-thiazole-5-carboxylic acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)C2=NC(=C(S2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)C2=NC(=C(S2)C(=O)O)C

InChI

InChI=1S/C18H21NO4S/c1-10-6-7-12(18(3,4)5)14(8-10)23-9-13(20)16-19-11(2)15(24-16)17(21)22/h6-8H,9H2,1-5H3,(H,21,22)