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

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-(4-methoxy-3-morpholin-4-yl-5-propan-2-yl-phenyl)ethanone hydrobromide Openeye Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-1-(3-isopropyl-4-methoxy-5-morpholino-phenyl)ethanone hydrobromide CAS Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-1-[4-methoxy-3-(4-morpholinyl)-5-propan-2-ylphenyl]ethanone hydrobromide IUPAC Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-1-(4-methoxy-3-morpholin-4-yl-5-propan-2-ylphenyl)ethanone hydrobromide Traditional Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-1-(3-isopropyl-4-methoxy-5-morpholino-phenyl)ethanone hydrobromide Formula: C28H37BrFN3O5 MolecularWeight: 594.512883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36FN3O5.BrH/c1-6-36-23-14-19-15-32(28(30)24(19)25(29)27(23)37-7-2)16-22(33)18-12-20(17(3)4)26(34-5)21(13-18)31-8-10-35-11-9-31;/h12-14,17,30H,6-11,15-16H2,1-5H3;1H