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

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-(4-tert-butyl-3-methoxy-2-morpholin-4-yl-phenyl)ethanone Openeye Name: 1-(4-tert-butyl-3-methoxy-2-morpholino-phenyl)-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone CAS Name: 1-[4-tert-butyl-3-methoxy-2-(4-morpholinyl)phenyl]-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone IUPAC Name: 1-(4-tert-butyl-3-methoxy-2-morpholin-4-ylphenyl)-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone Traditional Name: 1-(4-tert-butyl-3-methoxy-2-morpholino-phenyl)-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone Formula: C29H38FN3O5 MolecularWeight: 527.627523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C2C(=C1)CN(C2=N)CC(=O)C3=C(C(=C(C=C3)C(C)(C)C)OC)N4CCOCC4)F)OCC

Isomeric SMILES

CCOC1=C(C(=C2C(=C1)CN(C2=N)CC(=O)C3=C(C(=C(C=C3)C(C)(C)C)OC)N4CCOCC4)F)OCC

InChI

InChI=1S/C29H38FN3O5/c1-7-37-22-15-18-16-33(28(31)23(18)24(30)27(22)38-8-2)17-21(34)19-9-10-20(29(3,4)5)26(35-6)25(19)32-11-13-36-14-12-32/h9-10,15,31H,7-8,11-14,16-17H2,1-6H3