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

Systemtic Name: 3-[4-[4-(5-fluoranyl-2,3-dihydro-1-benzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1-methyl-indole-5-carbonitrile Openeye Name: 3-[4-[4-(5-fluoro-2,3-dihydrobenzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1-methyl-indole-5-carbonitrile CAS Name: 3-[4-[4-(5-fluoro-2,3-dihydrobenzofuran-7-yl)-1-piperazinyl]cyclohexyl]-1-methyl-5-indolecarbonitrile IUPAC Name: 3-[4-[4-(5-fluoro-2,3-dihydro-1-benzofuran-7-yl)piperazin-1-yl]cyclohexyl]-1-methylindole-5-carbonitrile Traditional Name: 3-[4-[4-(5-fluorocoumaran-7-yl)piperazino]cyclohexyl]-1-methyl-indole-5-carbonitrile Formula: C28H31FN4O MolecularWeight: 458.570343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C#N)C3CCC(CC3)N4CCN(CC4)C5=C6C(=CC(=C5)F)CCO6

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)C#N)C3CCC(CC3)N4CCN(CC4)C5=C6C(=CC(=C5)F)CCO6

InChI

InChI=1S/C28H31FN4O/c1-31-18-25(24-14-19(17-30)2-7-26(24)31)20-3-5-23(6-4-20)32-9-11-33(12-10-32)27-16-22(29)15-21-8-13-34-28(21)27/h2,7,14-16,18,20,23H,3-6,8-13H2,1H3