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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCOC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CCOC1=CC=CC=C1OCCOC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C

InChI

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