2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-(3-tert-butyl-5-ethoxy-4-oxidanyl-phenyl)ethanone

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-(3-tert-butyl-5-ethoxy-4-oxidanyl-phenyl)ethanone Openeye Name: 1-(3-tert-butyl-5-ethoxy-4-hydroxy-phenyl)-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone CAS Name: 1-(3-tert-butyl-5-ethoxy-4-hydroxyphenyl)-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone IUPAC Name: 1-(3-tert-butyl-5-ethoxy-4-hydroxyphenyl)-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone Traditional Name: 1-(3-tert-butyl-5-ethoxy-4-hydroxy-phenyl)-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone Formula: C26H33FN2O5 MolecularWeight: 472.549023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC

InChI

InChI=1S/C26H33FN2O5/c1-7-32-19-11-15(10-17(23(19)31)26(4,5)6)18(30)14-29-13-16-12-20(33-8-2)24(34-9-3)22(27)21(16)25(29)28/h10-12,28,31H,7-9,13-14H2,1-6H3