diethyl 2-acetamido-2-[(2-butylimidazol-1-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(2-butylimidazol-1-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(2-butylimidazol-1-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(2-butyl-1-imidazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(2-butylimidazol-1-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(2-butylimidazol-1-yl)methyl]malonic acid diethyl ester Formula: C17H27N3O5 MolecularWeight: 353.41338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CN1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCCCC1=NC=CN1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C17H27N3O5/c1-5-8-9-14-18-10-11-20(14)12-17(19-13(4)21,15(22)24-6-2)16(23)25-7-3/h10-11H,5-9,12H2,1-4H3,(H,19,21)