tert-butyl 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(1,3-dioxoisoindolin-2-yl)propyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[3-(1,3-dioxo-2-isoindolyl)propyl]-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(1,3-dioxoisoindol-2-yl)propyl]-3-oxopiperazine-1-carboxylate Traditional Name: 3-keto-4-(3-phthalimidopropyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)28-19(27)22-12-11-21(16(24)13-22)9-6-10-23-17(25)14-7-4-5-8-15(14)18(23)26/h4-5,7-8H,6,9-13H2,1-3H3