N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-cyclohexanecarboxamide

Systemtic Name: N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-cyclohexanecarboxamide Openeye Name: N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-cyclohexanecarboxamide CAS Name: N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methylcyclohexanecarboxamide IUPAC Name: N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methylcyclohexanecarboxamide Traditional Name: N-[[(3R)-1-[2-(2-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-cyclohexanecarboxamide Formula: C22H34FN2O+ MolecularWeight: 361.516563

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=CC=C2F)C(=O)C3CCCCC3

Isomeric SMILES

CN(C[C@H]1CCC[NH+](C1)CCC2=CC=CC=C2F)C(=O)C3CCCCC3

InChI

InChI=1S/C22H33FN2O/c1-24(22(26)20-10-3-2-4-11-20)16-18-8-7-14-25(17-18)15-13-19-9-5-6-12-21(19)23/h5-6,9,12,18,20H,2-4,7-8,10-11,13-17H2,1H3/p+1/t18-/m1/s1