(5-cyano-2-fluoranyl-phenyl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2-(4-ethoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2-(4-ethoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-p-phenetyl-isoindoline-5-carboxylic acid (5-cyano-2-fluoro-benzyl) ester Formula: C25H17FN2O5 MolecularWeight: 444.411283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

InChI

InChI=1S/C25H17FN2O5/c1-2-32-19-7-5-18(6-8-19)28-23(29)20-9-4-16(12-21(20)24(28)30)25(31)33-14-17-11-15(13-27)3-10-22(17)26/h3-12H,2,14H2,1H3