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

Systemtic Name: dimethyl 2-acetamido-2-[[2-(methoxymethyl)-5-methyl-3-oxidanylidene-1,2-thiazol-4-yl]methyl]propanedioate Openeye Name: dimethyl 2-acetamido-2-[[2-(methoxymethyl)-5-methyl-3-oxo-isothiazol-4-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[2-(methoxymethyl)-5-methyl-3-oxo-4-isothiazolyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-acetamido-2-[[2-(methoxymethyl)-5-methyl-3-oxo-1,2-thiazol-4-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-keto-2-(methoxymethyl)-5-methyl-4-isothiazolin-4-yl]methyl]malonic acid dimethyl ester Formula: C14H20N2O7S MolecularWeight: 360.3828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(S1)COC)CC(C(=O)OC)(C(=O)OC)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N(S1)COC)CC(C(=O)OC)(C(=O)OC)NC(=O)C

InChI

InChI=1S/C14H20N2O7S/c1-8-10(11(18)16(24-8)7-21-3)6-14(12(19)22-4,13(20)23-5)15-9(2)17/h6-7H2,1-5H3,(H,15,17)