2-(5-bromanyl-2-ethoxy-3-methoxy-phenyl)-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-(5-bromanyl-2-ethoxy-3-methoxy-phenyl)-1,3-thiazole-4-carboxylic acid Openeye Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)thiazole-4-carboxylic acid CAS Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-4-thiazolecarboxylic acid IUPAC Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxylic acid Traditional Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)thiazole-4-carboxylic acid Formula: C13H12BrNO4S MolecularWeight: 358.20768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C2=NC(=CS2)C(=O)O)Br)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1C2=NC(=CS2)C(=O)O)Br)OC

InChI

InChI=1S/C13H12BrNO4S/c1-3-19-11-8(4-7(14)5-10(11)18-2)12-15-9(6-20-12)13(16)17/h4-6H,3H2,1-2H3,(H,16,17)