2-[3-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC(=CS2)C(=O)O)OCCOC3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC(=CS2)C(=O)O)OCCOC3=CC=CC=C3C

InChI

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