3-[4-[4-(2,3-dihydro-1-benzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[4-(2,3-dihydrobenzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-(2,3-dihydrobenzofuran-7-yl)-1-piperazinyl]cyclohexyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-(4-coumaran-7-ylpiperazino)cyclohexyl]-1H-indole-5-carbonitrile Formula: C27H30N4O MolecularWeight: 426.5533

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CNC3=C2C=C(C=C3)C#N)N4CCN(CC4)C5=CC=CC6=C5OCC6

Isomeric SMILES

C1CC(CCC1C2=CNC3=C2C=C(C=C3)C#N)N4CCN(CC4)C5=CC=CC6=C5OCC6

InChI

InChI=1S/C27H30N4O/c28-17-19-4-9-25-23(16-19)24(18-29-25)20-5-7-22(8-6-20)30-11-13-31(14-12-30)26-3-1-2-21-10-15-32-27(21)26/h1-4,9,16,18,20,22,29H,5-8,10-15H2