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

Systemtic Name: 2-(5-bromanyl-2-ethoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(5-bromo-2-ethoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(5-bromo-2-ethoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(5-bromo-2-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(5-bromo-2-ethoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C13H12BrNO3S MolecularWeight: 342.20828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2=NC(=C(S2)C(=O)O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2=NC(=C(S2)C(=O)O)C

InChI

InChI=1S/C13H12BrNO3S/c1-3-18-10-5-4-8(14)6-9(10)12-15-7(2)11(19-12)13(16)17/h4-6H,3H2,1-2H3,(H,16,17)