(5-cyano-2-fluoranyl-phenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 4-(1,3-dioxoisoindolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)benzoic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 4-(1,3-dioxoisoindol-2-yl)benzoate Traditional Name: 4-phthalimidobenzoic acid (5-cyano-2-fluoro-benzyl) ester Formula: C23H13FN2O4 MolecularWeight: 400.358723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC4=C(C=CC(=C4)C#N)F

InChI

InChI=1S/C23H13FN2O4/c24-20-10-5-14(12-25)11-16(20)13-30-23(29)15-6-8-17(9-7-15)26-21(27)18-3-1-2-4-19(18)22(26)28/h1-11H,13H2