diethyl 2-acetamido-2-[(2-phenylmethoxypyrazol-3-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(2-phenylmethoxypyrazol-3-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(2-benzyloxypyrazol-3-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(2-phenylmethoxy-3-pyrazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(2-phenylmethoxypyrazol-3-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(2-benzoxypyrazol-3-yl)methyl]malonic acid diethyl ester Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=NN1OCC2=CC=CC=C2)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=NN1OCC2=CC=CC=C2)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C20H25N3O6/c1-4-27-18(25)20(22-15(3)24,19(26)28-5-2)13-17-11-12-21-23(17)29-14-16-9-7-6-8-10-16/h6-12H,4-5,13-14H2,1-3H3,(H,22,24)