(5-cyano-2-fluoranyl-phenyl)methyl 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2-(2-chlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-chlorophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2-(2-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-chlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid (5-cyano-2-fluoro-benzyl) ester Formula: C23H12ClFN2O4 MolecularWeight: 434.803783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F)Cl

InChI

InChI=1S/C23H12ClFN2O4/c24-18-3-1-2-4-20(18)27-21(28)16-7-6-14(10-17(16)22(27)29)23(30)31-12-15-9-13(11-26)5-8-19(15)25/h1-10H,12H2