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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCOC2=C(C=CC=C2OC)C3=NC(=CS3)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCCOC2=C(C=CC=C2OC)C3=NC(=CS3)C(=O)O

InChI

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