diethyl 2-[[[1-(phenylmethyl)imidazol-4-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[1-(phenylmethyl)imidazol-4-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(1-benzylimidazol-4-yl)amino]methylene]propanedioate CAS Name: 2-[[[1-(phenylmethyl)-4-imidazolyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(1-benzylimidazol-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(1-benzylimidazol-4-yl)amino]methylene]malonic acid diethyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CN(C=N1)CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CN(C=N1)CC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H21N3O4/c1-3-24-17(22)15(18(23)25-4-2)10-19-16-12-21(13-20-16)11-14-8-6-5-7-9-14/h5-10,12-13,19H,3-4,11H2,1-2H3