ditert-butyl 2-[2-[1,3-bis(oxidanylidene)-5-phenylmethoxy-isoindol-2-yl]ethyl]propanedioate

Systemtic Name: ditert-butyl 2-[2-[1,3-bis(oxidanylidene)-5-phenylmethoxy-isoindol-2-yl]ethyl]propanedioate Openeye Name: ditert-butyl 2-[2-(5-benzyloxy-1,3-dioxo-isoindolin-2-yl)ethyl]propanedioate CAS Name: 2-[2-(1,3-dioxo-5-phenylmethoxy-2-isoindolyl)ethyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[2-(1,3-dioxo-5-phenylmethoxyisoindol-2-yl)ethyl]propanedioate Traditional Name: 2-[2-(5-benzoxy-1,3-diketo-isoindolin-2-yl)ethyl]malonic acid ditert-butyl ester Formula: C28H33NO7 MolecularWeight: 495.56412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCN1C(=O)C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCN1C(=O)C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H33NO7/c1-27(2,3)35-25(32)21(26(33)36-28(4,5)6)14-15-29-23(30)20-13-12-19(16-22(20)24(29)31)34-17-18-10-8-7-9-11-18/h7-13,16,21H,14-15,17H2,1-6H3