ditert-butyl 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-2-but-3-enyl-propanedioate

Systemtic Name: ditert-butyl 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl]-2-but-3-enyl-propanedioate Openeye Name: ditert-butyl 2-but-3-enyl-2-[3-(1,3-dioxoisoindolin-2-yl)propyl]propanedioate CAS Name: 2-but-3-enyl-2-[3-(1,3-dioxo-2-isoindolyl)propyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-but-3-enyl-2-[3-(1,3-dioxoisoindol-2-yl)propyl]propanedioate Traditional Name: 2-but-3-enyl-2-(3-phthalimidopropyl)malonic acid ditert-butyl ester Formula: C26H35NO6 MolecularWeight: 457.5592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(CCC=C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(CCC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H35NO6/c1-8-9-15-26(22(30)32-24(2,3)4,23(31)33-25(5,6)7)16-12-17-27-20(28)18-13-10-11-14-19(18)21(27)29/h8,10-11,13-14H,1,9,12,15-17H2,2-7H3