ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-1-benzofuran-6-carboxylate

Systemtic Name: ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-1-benzofuran-6-carboxylate Openeye Name: ethyl 2-[4-(1,3-dioxoisoindolin-2-yl)butyl]benzofuran-6-carboxylate CAS Name: 2-[4-(1,3-dioxo-2-isoindolyl)butyl]-6-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-dioxoisoindol-2-yl)butyl]-1-benzofuran-6-carboxylate Traditional Name: 2-(4-phthalimidobutyl)benzofuran-6-carboxylic acid ethyl ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)C=C(O2)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)C=C(O2)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H21NO5/c1-2-28-23(27)16-11-10-15-13-17(29-20(15)14-16)7-5-6-12-24-21(25)18-8-3-4-9-19(18)22(24)26/h3-4,8-11,13-14H,2,5-7,12H2,1H3