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

Systemtic Name: 2-fluoranyl-4-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 2-fluoro-4-(4-spiro[1H-isobenzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzonitrile CAS Name: 2-fluoro-4-[4-(1'-spiro[1H-isobenzofuran-3,4'-cyclohexane]yl)-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-4-(4-spiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-ylpiperazin-1-yl)benzonitrile Traditional Name: 2-fluoro-4-(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=CC(=C(C=C4)C#N)F)C5=CC=CC=C5CO2

Isomeric SMILES

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

InChI

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