3-ethyl-4-methoxycarbonyl-1,2-thiazole-5-carboxylic acid

Systemtic Name: 3-ethyl-4-methoxycarbonyl-1,2-thiazole-5-carboxylic acid Openeye Name: 3-ethyl-4-methoxycarbonyl-isothiazole-5-carboxylic acid CAS Name: 3-ethyl-4-methoxycarbonyl-5-isothiazolecarboxylic acid IUPAC Name: 3-ethyl-4-methoxycarbonyl-1,2-thiazole-5-carboxylic acid Traditional Name: 4-carbomethoxy-3-ethyl-isothiazole-5-carboxylic acid Formula: C8H9NO4S MolecularWeight: 215.22636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NSC(=C1C(=O)OC)C(=O)O

Isomeric SMILES

CCC1=NSC(=C1C(=O)OC)C(=O)O

InChI

InChI=1S/C8H9NO4S/c1-3-4-5(8(12)13-2)6(7(10)11)14-9-4/h3H2,1-2H3,(H,10,11)