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

Systemtic Name: 1-(3-azanylidene-4-fluoranyl-5,6-dimethoxy-1H-isoindol-2-yl)-2-[4-methoxy-3-(3-oxidanylpropylamino)phenyl]hexan-1-one hydrobromide Openeye Name: 1-(7-fluoro-1-imino-5,6-dimethoxy-isoindolin-2-yl)-2-[3-(3-hydroxypropylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide CAS Name: 1-(4-fluoro-3-imino-5,6-dimethoxy-1H-isoindol-2-yl)-2-[3-(3-hydroxypropylamino)-4-methoxyphenyl]-1-hexanone hydrobromide IUPAC Name: 1-(4-fluoro-3-imino-5,6-dimethoxy-1H-isoindol-2-yl)-2-[3-(3-hydroxypropylamino)-4-methoxyphenyl]hexan-1-one hydrobromide Traditional Name: 1-(7-fluoro-1-imino-5,6-dimethoxy-isoindolin-2-yl)-2-[3-(3-hydroxypropylamino)-4-methoxy-phenyl]hexan-1-one hydrobromide Formula: C26H35BrFN3O5 MolecularWeight: 568.475603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O5.BrH/c1-5-6-8-18(16-9-10-20(33-2)19(13-16)29-11-7-12-31)26(32)30-15-17-14-21(34-3)24(35-4)23(27)22(17)25(30)28;/h9-10,13-14,18,28-29,31H,5-8,11-12,15H2,1-4H3;1H