1-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide

Systemtic Name: 1-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide Openeye Name: 1-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide CAS Name: 1-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxyphenyl]-1-hexanone hydrobromide IUPAC Name: 1-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxyphenyl]hexan-1-one hydrobromide Traditional Name: 1-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-[3-(2-hydroxyethylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide Formula: C27H37BrFN3O5 MolecularWeight: 582.502183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)OC)NCCO)C(=O)N2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC.Br

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)OC)NCCO)C(=O)N2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC.Br

InChI

InChI=1S/C27H36FN3O5.BrH/c1-5-8-9-19(17-10-11-21(34-4)20(14-17)30-12-13-32)27(33)31-16-18-15-22(35-6-2)25(36-7-3)24(28)23(18)26(31)29;/h10-11,14-15,19,29-30,32H,5-9,12-13,16H2,1-4H3;1H