diethyl 2-acetamido-2-[(2-methyl-3-phenylmethoxy-imidazol-4-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(2-methyl-3-phenylmethoxy-imidazol-4-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(3-benzyloxy-2-methyl-imidazol-4-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(2-methyl-3-phenylmethoxy-4-imidazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(2-methyl-3-phenylmethoxyimidazol-4-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(3-benzoxy-2-methyl-imidazol-4-yl)methyl]malonic acid diethyl ester Formula: C21H27N3O6 MolecularWeight: 417.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=C(N1OCC2=CC=CC=C2)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CN=C(N1OCC2=CC=CC=C2)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C21H27N3O6/c1-5-28-19(26)21(23-16(4)25,20(27)29-6-2)12-18-13-22-15(3)24(18)30-14-17-10-8-7-9-11-17/h7-11,13H,5-6,12,14H2,1-4H3,(H,23,25)