diethyl 2-acetamido-2-[(3-ethoxycarbonyl-5-thiophen-2-yl-1,2-oxazol-4-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(3-ethoxycarbonyl-5-thiophen-2-yl-1,2-oxazol-4-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-ethoxycarbonyl-5-(2-thienyl)isoxazol-4-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[(3-ethoxycarbonyl-5-thiophen-2-yl-4-isoxazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(3-ethoxycarbonyl-5-thiophen-2-yl-1,2-oxazol-4-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-carbethoxy-5-(2-thienyl)isoxazol-4-yl]methyl]malonic acid diethyl ester Formula: C20H24N2O8S MolecularWeight: 452.47816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=CC=CS2

InChI

InChI=1S/C20H24N2O8S/c1-5-27-17(24)15-13(16(30-22-15)14-9-8-10-31-14)11-20(21-12(4)23,18(25)28-6-2)19(26)29-7-3/h8-10H,5-7,11H2,1-4H3,(H,21,23)