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

Systemtic Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[3-ethoxy-4-(p-tolylmethoxy)phenyl]-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[3-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-4-ethyl-thiazole-5-carboxylic acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C)OCC)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C)OCC)C(=O)O

InChI

InChI=1S/C22H23NO4S/c1-4-17-20(22(24)25)28-21(23-17)16-10-11-18(19(12-16)26-5-2)27-13-15-8-6-14(3)7-9-15/h6-12H,4-5,13H2,1-3H3,(H,24,25)