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

Systemtic Name: 2-(5-bromanyl-2-ethoxy-3-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C14H14BrNO4S MolecularWeight: 372.23426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C2=NC(=C(S2)C(=O)O)C)Br)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1C2=NC(=C(S2)C(=O)O)C)Br)OC

InChI

InChI=1S/C14H14BrNO4S/c1-4-20-11-9(5-8(15)6-10(11)19-3)13-16-7(2)12(21-13)14(17)18/h5-6H,4H2,1-3H3,(H,17,18)