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

Systemtic Name: 1-(3-azanylidene-4-fluoranyl-5,6-dimethoxy-1H-isoindol-2-yl)-2-[4-methoxy-3-(4-methyl-4-oxidanyl-piperidin-1-yl)phenyl]hexan-1-one hydrobromide Openeye Name: 1-(7-fluoro-1-imino-5,6-dimethoxy-isoindolin-2-yl)-2-[3-(4-hydroxy-4-methyl-1-piperidyl)-4-methoxy-phenyl]hexan-1-one hydrobromide CAS Name: 1-(4-fluoro-3-imino-5,6-dimethoxy-1H-isoindol-2-yl)-2-[3-(4-hydroxy-4-methyl-1-piperidinyl)-4-methoxyphenyl]-1-hexanone hydrobromide IUPAC Name: 1-(4-fluoro-3-imino-5,6-dimethoxy-1H-isoindol-2-yl)-2-[3-(4-hydroxy-4-methylpiperidin-1-yl)-4-methoxyphenyl]hexan-1-one hydrobromide Traditional Name: 1-(7-fluoro-1-imino-5,6-dimethoxy-isoindolin-2-yl)-2-[3-(4-hydroxy-4-methyl-piperidino)-4-methoxy-phenyl]hexan-1-one hydrobromide Formula: C29H39BrFN3O5 MolecularWeight: 608.539463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)OC)N2CCC(CC2)(C)O)C(=O)N3CC4=CC(=C(C(=C4C3=N)F)OC)OC.Br

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)OC)N2CCC(CC2)(C)O)C(=O)N3CC4=CC(=C(C(=C4C3=N)F)OC)OC.Br

InChI

InChI=1S/C29H38FN3O5.BrH/c1-6-7-8-20(18-9-10-22(36-3)21(15-18)32-13-11-29(2,35)12-14-32)28(34)33-17-19-16-23(37-4)26(38-5)25(30)24(19)27(33)31;/h9-10,15-16,20,31,35H,6-8,11-14,17H2,1-5H3;1H