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

Systemtic Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(1H-1,2,4-triazol-5-yl)-1,2-oxazol-4-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(1H-1,2,4-triazol-5-yl)isoxazol-4-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[3-ethoxy-5-(1H-1,2,4-triazol-5-yl)-4-isoxazolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-ethoxy-5-(1H-1,2,4-triazol-5-yl)-1,2-oxazol-4-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-ethoxy-5-(1H-1,2,4-triazol-5-yl)isoxazol-4-yl]methyl]malonic acid diethyl ester Formula: C17H23N5O7 MolecularWeight: 409.39382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=NC=NN2

Isomeric SMILES

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C2=NC=NN2

InChI

InChI=1S/C17H23N5O7/c1-5-26-14-11(12(29-22-14)13-18-9-19-21-13)8-17(20-10(4)23,15(24)27-6-2)16(25)28-7-3/h9H,5-8H2,1-4H3,(H,20,23)(H,18,19,21)