2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-4-methoxy-2-(methylamino)-1-phenyl-butan-1-one hydrobromide

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-4-methoxy-2-(methylamino)-1-phenyl-butan-1-one hydrobromide Openeye Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-4-methoxy-2-(methylamino)-1-phenyl-butan-1-one hydrobromide CAS Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-4-methoxy-2-(methylamino)-1-phenyl-1-butanone hydrobromide IUPAC Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-4-methoxy-2-(methylamino)-1-phenylbutan-1-one hydrobromide Traditional Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-4-methoxy-2-(methylamino)-1-phenyl-butan-1-one hydrobromide Formula: C24H31BrFN3O4 MolecularWeight: 524.423043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30FN3O4.BrH/c1-5-31-18-14-17-15-28(23(26)19(17)20(25)21(18)32-6-2)24(27-3,12-13-30-4)22(29)16-10-8-7-9-11-16;/h7-11,14,26-27H,5-6,12-13,15H2,1-4H3;1H