dimethyl 2-acetamido-2-[[5-tert-butyl-2-(methoxymethyl)-3-oxidanylidene-1,2-thiazol-4-yl]methyl]propanedioate

Systemtic Name: dimethyl 2-acetamido-2-[[5-tert-butyl-2-(methoxymethyl)-3-oxidanylidene-1,2-thiazol-4-yl]methyl]propanedioate Openeye Name: dimethyl 2-acetamido-2-[[5-tert-butyl-2-(methoxymethyl)-3-oxo-isothiazol-4-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[5-tert-butyl-2-(methoxymethyl)-3-oxo-4-isothiazolyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-acetamido-2-[[5-tert-butyl-2-(methoxymethyl)-3-oxo-1,2-thiazol-4-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[5-tert-butyl-3-keto-2-(methoxymethyl)-4-isothiazolin-4-yl]methyl]malonic acid dimethyl ester Formula: C17H26N2O7S MolecularWeight: 402.46254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(SN(C1=O)COC)C(C)(C)C)(C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=C(SN(C1=O)COC)C(C)(C)C)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H26N2O7S/c1-10(20)18-17(14(22)25-6,15(23)26-7)8-11-12(16(2,3)4)27-19(9-24-5)13(11)21/h8-9H2,1-7H3,(H,18,20)