dimethyl 2-(3-oxidanylidene-1,2-thiazol-2-yl)propanedioate

Systemtic Name: dimethyl 2-(3-oxidanylidene-1,2-thiazol-2-yl)propanedioate Openeye Name: dimethyl 2-(3-oxoisothiazol-2-yl)propanedioate CAS Name: 2-(3-oxo-2-isothiazolyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3-oxo-1,2-thiazol-2-yl)propanedioate Traditional Name: 2-(3-keto-4-isothiazolin-2-yl)malonic acid dimethyl ester Formula: C8H9NO5S MolecularWeight: 231.22576

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=O)OC)N1C(=O)C=CS1

Isomeric SMILES

COC(=O)C(C(=O)OC)N1C(=O)C=CS1

InChI

InChI=1S/C8H9NO5S/c1-13-7(11)6(8(12)14-2)9-5(10)3-4-15-9/h3-4,6H,1-2H3