[2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-(3-methylbenzofuran-2-yl)-2-oxo-ethyl] 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid [2-(3-methyl-2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxoethyl] 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid [2-keto-2-(3-methylbenzofuran-2-yl)ethyl] ester Formula: C22H17NO6 MolecularWeight: 391.37348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17NO6/c1-13-14-6-4-5-9-18(14)29-20(13)17(24)12-28-19(25)10-11-23-21(26)15-7-2-3-8-16(15)22(23)27/h2-9H,10-12H2,1H3