(3,4-dimethylphenyl) 2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (3,4-dimethylphenyl) 2-isobutyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-methylpropyl)-1,3-dioxo-5-isoindolecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-(2-methylpropyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-isobutyl-1,3-diketo-isoindoline-5-carboxylic acid (3,4-dimethylphenyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC(C)C)C

InChI

InChI=1S/C21H21NO4/c1-12(2)11-22-19(23)17-8-6-15(10-18(17)20(22)24)21(25)26-16-7-5-13(3)14(4)9-16/h5-10,12H,11H2,1-4H3