diethyl 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylene]propanedioate CAS Name: 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[3-cyano-4-(4-fluorophenyl)-1H-pyrrol-2-yl]amino]methylene]malonic acid diethyl ester Formula: C19H18FN3O4 MolecularWeight: 371.362323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C(=CN1)C2=CC=C(C=C2)F)C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=C(C(=CN1)C2=CC=C(C=C2)F)C#N)C(=O)OCC

InChI

InChI=1S/C19H18FN3O4/c1-3-26-18(24)16(19(25)27-4-2)11-23-17-14(9-21)15(10-22-17)12-5-7-13(20)8-6-12/h5-8,10-11,22-23H,3-4H2,1-2H3