3-[1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]propyl 2,2-dimethylbutanoate

Systemtic Name: 3-[1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]propyl 2,2-dimethylbutanoate Openeye Name: 3-(1,3-dioxobenzo[f]isoindol-2-yl)propyl 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid 3-(1,3-dioxo-2-benzo[f]isoindolyl)propyl ester IUPAC Name: 3-(1,3-dioxobenzo[f]isoindol-2-yl)propyl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid 3-(1,3-diketobenz[f]isoindol-2-yl)propyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCCCN1C(=O)C2=CC3=CC=CC=C3C=C2C1=O

Isomeric SMILES

CCC(C)(C)C(=O)OCCCN1C(=O)C2=CC3=CC=CC=C3C=C2C1=O

InChI

InChI=1S/C21H23NO4/c1-4-21(2,3)20(25)26-11-7-10-22-18(23)16-12-14-8-5-6-9-15(14)13-17(16)19(22)24/h5-6,8-9,12-13H,4,7,10-11H2,1-3H3