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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Br)OCC

InChI

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