ethyl 5-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyloxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyloxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[4-(1,3-dioxoisoindolin-2-yl)butanoyloxy]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[4-(1,3-dioxo-2-isoindolyl)-1-oxobutoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(1,3-dioxoisoindol-2-yl)butanoyloxy]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 2-phenyl-5-(4-phthalimidobutanoyloxy)benzofuran-3-carboxylic acid ethyl ester Formula: C29H23NO7 MolecularWeight: 497.49542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C29H23NO7/c1-2-35-29(34)25-22-17-19(14-15-23(22)37-26(25)18-9-4-3-5-10-18)36-24(31)13-8-16-30-27(32)20-11-6-7-12-21(20)28(30)33/h3-7,9-12,14-15,17H,2,8,13,16H2,1H3