(3,3-dimethyl-2-oxidanylidene-butyl) 2-(4-methoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(4-methoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(4-methoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(4-methoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-methoxyphenyl)isoindoline-5-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21NO6/c1-22(2,3)18(24)12-29-21(27)13-5-10-16-17(11-13)20(26)23(19(16)25)14-6-8-15(28-4)9-7-14/h5-11H,12H2,1-4H3