4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]thiazole-5-carboxylic acid CAS Name: 4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]-5-thiazolecarboxylic acid IUPAC Name: 4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 4-ethyl-2-[3-[2-(3-methoxyphenoxy)ethoxy]phenyl]thiazole-5-carboxylic acid Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=CC=C2)OCCOC3=CC=CC(=C3)OC)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=CC=C2)OCCOC3=CC=CC(=C3)OC)C(=O)O

InChI

InChI=1S/C21H21NO5S/c1-3-18-19(21(23)24)28-20(22-18)14-6-4-8-16(12-14)26-10-11-27-17-9-5-7-15(13-17)25-2/h4-9,12-13H,3,10-11H2,1-2H3,(H,23,24)