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

Systemtic Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(trifluoromethyl)isoxazol-4-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[3-ethoxy-5-(trifluoromethyl)-4-isoxazolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-ethoxy-5-(trifluoromethyl)isoxazol-4-yl]methyl]malonic acid diethyl ester Formula: C16H21F3N2O7 MolecularWeight: 410.34235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C(F)(F)F

Isomeric SMILES

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O7/c1-5-25-12-10(11(28-21-12)16(17,18)19)8-15(20-9(4)22,13(23)26-6-2)14(24)27-7-3/h5-8H2,1-4H3,(H,20,22)