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

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(5-bromo-2-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C12H10BrNO3S MolecularWeight: 328.1817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=C(C=CC(=C2)Br)OC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2=C(C=CC(=C2)Br)OC)C(=O)O

InChI

InChI=1S/C12H10BrNO3S/c1-6-10(12(15)16)18-11(14-6)8-5-7(13)3-4-9(8)17-2/h3-5H,1-2H3,(H,15,16)