ditert-butyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]piperazine-1,4-dicarboxylate

Systemtic Name: ditert-butyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]piperazine-1,4-dicarboxylate Openeye Name: ditert-butyl 2-[(1,3-dioxoisoindolin-2-yl)oxymethyl]piperazine-1,4-dicarboxylate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)oxymethyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(1,3-dioxoisoindol-2-yl)oxymethyl]piperazine-1,4-dicarboxylate Traditional Name: 2-(phthalimidooxymethyl)piperazine-1,4-dicarboxylic acid ditert-butyl ester Formula: C23H31N3O7 MolecularWeight: 461.50814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)CON2C(=O)C3=CC=CC=C3C2=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)CON2C(=O)C3=CC=CC=C3C2=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O7/c1-22(2,3)32-20(29)24-11-12-25(21(30)33-23(4,5)6)15(13-24)14-31-26-18(27)16-9-7-8-10-17(16)19(26)28/h7-10,15H,11-14H2,1-6H3