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

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-[3-(dimethylamino)-4-methoxy-5-propan-2-yl-phenyl]ethanone hydrobromide Openeye Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-1-[3-(dimethylamino)-5-isopropyl-4-methoxy-phenyl]ethanone hydrobromide CAS Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-1-[3-(dimethylamino)-4-methoxy-5-propan-2-ylphenyl]ethanone hydrobromide IUPAC Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-1-[3-(dimethylamino)-4-methoxy-5-propan-2-ylphenyl]ethanone hydrobromide Traditional Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-1-[3-(dimethylamino)-5-isopropyl-4-methoxy-phenyl]ethanone hydrobromide Formula: C26H35BrFN3O4 MolecularWeight: 552.476203

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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)N(C)C)OC)C(C)C)F)OCC.Br

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O4.BrH/c1-8-33-21-12-17-13-30(26(28)22(17)23(27)25(21)34-9-2)14-20(31)16-10-18(15(3)4)24(32-7)19(11-16)29(5)6;/h10-12,15,28H,8-9,13-14H2,1-7H3;1H