[2-(1-methoxypropan-2-yl)-3-oxidanylidene-1H-isoindol-5-yl] 4-cyanobenzoate

Systemtic Name: [2-(1-methoxypropan-2-yl)-3-oxidanylidene-1H-isoindol-5-yl] 4-cyanobenzoate Openeye Name: [2-(2-methoxy-1-methyl-ethyl)-3-oxo-isoindolin-5-yl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(1-methoxypropan-2-yl)-3-oxo-1H-isoindol-5-yl] ester IUPAC Name: [2-(1-methoxypropan-2-yl)-3-oxo-1H-isoindol-5-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [3-keto-2-(2-methoxy-1-methyl-ethyl)isoindolin-5-yl] ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1CC2=C(C1=O)C=C(C=C2)OC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(COC)N1CC2=C(C1=O)C=C(C=C2)OC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H18N2O4/c1-13(12-25-2)22-11-16-7-8-17(9-18(16)19(22)23)26-20(24)15-5-3-14(10-21)4-6-15/h3-9,13H,11-12H2,1-2H3