1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Openeye Name: 1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one CAS Name: 1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Traditional Name: 1-cyclohexyl-2-(2-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazino]butan-1-one Formula: C27H35FN2O2 MolecularWeight: 438.577403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CC=CC=C3F)C(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CC=CC=C3F)C(=O)C4CCCCC4

InChI

InChI=1S/C27H35FN2O2/c1-32-26-14-8-7-13-25(26)30-19-17-29(18-20-30)16-15-23(22-11-5-6-12-24(22)28)27(31)21-9-3-2-4-10-21/h5-8,11-14,21,23H,2-4,9-10,15-20H2,1H3