diethyl 2-[[1-(phenylmethyl)imidazol-2-yl]methyl]propanedioate

Systemtic Name: diethyl 2-[[1-(phenylmethyl)imidazol-2-yl]methyl]propanedioate Openeye Name: diethyl 2-[(1-benzylimidazol-2-yl)methyl]propanedioate CAS Name: 2-[[1-(phenylmethyl)-2-imidazolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(1-benzylimidazol-2-yl)methyl]propanedioate Traditional Name: 2-[(1-benzylimidazol-2-yl)methyl]malonic acid diethyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=NC=CN1CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=NC=CN1CC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H22N2O4/c1-3-23-17(21)15(18(22)24-4-2)12-16-19-10-11-20(16)13-14-8-6-5-7-9-14/h5-11,15H,3-4,12-13H2,1-2H3