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

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2-benzyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxylic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2-benzyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-benzyl-1,3-diketo-isoindoline-5-carboxylic acid (5-cyano-2-fluoro-benzyl) ester Formula: C24H15FN2O4 MolecularWeight: 414.385303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

InChI

InChI=1S/C24H15FN2O4/c25-21-9-6-16(12-26)10-18(21)14-31-24(30)17-7-8-19-20(11-17)23(29)27(22(19)28)13-15-4-2-1-3-5-15/h1-11H,13-14H2