diethyl 2-[[[3-[imidazol-1-yl(phenyl)methyl]-4-methoxy-phenyl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[3-[imidazol-1-yl(phenyl)methyl]-4-methoxy-phenyl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[3-[imidazol-1-yl(phenyl)methyl]-4-methoxy-anilino]methylene]propanedioate CAS Name: 2-[[3-[1-imidazolyl(phenyl)methyl]-4-methoxyanilino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-[imidazol-1-yl(phenyl)methyl]-4-methoxyanilino]methylidene]propanedioate Traditional Name: 2-[[3-[imidazol-1-yl(phenyl)methyl]-4-methoxy-anilino]methylene]malonic acid diethyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1)OC)C(C2=CC=CC=C2)N3C=CN=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC(=C(C=C1)OC)C(C2=CC=CC=C2)N3C=CN=C3)C(=O)OCC

InChI

InChI=1S/C25H27N3O5/c1-4-32-24(29)21(25(30)33-5-2)16-27-19-11-12-22(31-3)20(15-19)23(28-14-13-26-17-28)18-9-7-6-8-10-18/h6-17,23,27H,4-5H2,1-3H3