[(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-acetamidophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-(4-acetamidophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-acetamidophenyl)-1,3-dioxo-5-isoindolecarboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-acetamidophenyl)-1,3-diketo-isoindoline-5-carboxylic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C21H16N2O7 MolecularWeight: 408.36094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4CCOC4=O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O[C@H]4CCOC4=O

InChI

InChI=1S/C21H16N2O7/c1-11(24)22-13-3-5-14(6-4-13)23-18(25)15-7-2-12(10-16(15)19(23)26)20(27)30-17-8-9-29-21(17)28/h2-7,10,17H,8-9H2,1H3,(H,22,24)/t17-/m0/s1