5-fluoranyl-2-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 5-fluoranyl-2-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 5-fluoro-2-(4-spiro[1H-isobenzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzonitrile CAS Name: 5-fluoro-2-[4-(1'-spiro[1H-isobenzofuran-3,4'-cyclohexane]yl)-1-piperazinyl]benzonitrile IUPAC Name: 5-fluoro-2-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzonitrile Traditional Name: 5-fluoro-2-(4-spiro[cyclohexane-4,1'-phthalan]-1-ylpiperazino)benzonitrile Formula: C24H26FN3O MolecularWeight: 391.481143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1N3CCN(CC3)C4=C(C=C(C=C4)F)C#N)C5=CC=CC=C5CO2

Isomeric SMILES

C1CC2(CCC1N3CCN(CC3)C4=C(C=C(C=C4)F)C#N)C5=CC=CC=C5CO2

InChI

InChI=1S/C24H26FN3O/c25-20-5-6-23(19(15-20)16-26)28-13-11-27(12-14-28)21-7-9-24(10-8-21)22-4-2-1-3-18(22)17-29-24/h1-6,15,21H,7-14,17H2