[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-cyano-3-phenyl-propyl] (phenylmethyl) carbonate

Systemtic Name: [2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-cyano-3-phenyl-propyl] (phenylmethyl) carbonate Openeye Name: benzyl [1-cyano-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propyl] carbonate CAS Name: carbonic acid [1-cyano-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropyl] (phenylmethyl) ester IUPAC Name: benzyl [1-cyano-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropyl] carbonate Traditional Name: carbonic acid benzyl (1-cyano-3-phenyl-2-phthalimido-propyl) ester Formula: C26H20N2O5 MolecularWeight: 440.4474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C#N)OC(=O)OCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C#N)OC(=O)OCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H20N2O5/c27-16-23(33-26(31)32-17-19-11-5-2-6-12-19)22(15-18-9-3-1-4-10-18)28-24(29)20-13-7-8-14-21(20)25(28)30/h1-14,22-23H,15,17H2