cyclohexyl-[2-[[4-(5-fluoranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone

Systemtic Name: cyclohexyl-[2-[[4-(5-fluoranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone Openeye Name: cyclohexyl-[2-[[4-(5-fluoro-2-methyl-phenyl)piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone CAS Name: cyclohexyl-[2-[[4-(5-fluoro-2-methylphenyl)-1-piperazinyl]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone IUPAC Name: cyclohexyl-[2-[[4-(5-fluoro-2-methylphenyl)piperazin-1-yl]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone Traditional Name: cyclohexyl-[2-[[4-(5-fluoro-2-methyl-phenyl)piperazino]methyl]-3,4-dihydro-2H-quinolin-1-yl]methanone Formula: C28H36FN3O MolecularWeight: 449.603343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)N2CCN(CC2)CC3CCC4=CC=CC=C4N3C(=O)C5CCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)F)N2CCN(CC2)CC3CCC4=CC=CC=C4N3C(=O)C5CCCCC5

InChI

InChI=1S/C28H36FN3O/c1-21-11-13-24(29)19-27(21)31-17-15-30(16-18-31)20-25-14-12-22-7-5-6-10-26(22)32(25)28(33)23-8-3-2-4-9-23/h5-7,10-11,13,19,23,25H,2-4,8-9,12,14-18,20H2,1H3