methyl 5-carboxyoxy-3-ethyl-1,2-thiazole-4-carboxylate

Systemtic Name: methyl 5-carboxyoxy-3-ethyl-1,2-thiazole-4-carboxylate Openeye Name: methyl 5-carboxyoxy-3-ethyl-isothiazole-4-carboxylate CAS Name: 5-carboxyoxy-3-ethyl-4-isothiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-carboxyoxy-3-ethyl-1,2-thiazole-4-carboxylate Traditional Name: 5-carboxyoxy-3-ethyl-isothiazole-4-carboxylic acid methyl ester Formula: C8H9NO5S MolecularWeight: 231.22576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9NO5S/c1-3-4-5(6(10)13-2)7(15-9-4)14-8(11)12/h3H2,1-2H3,(H,11,12)