3-[[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-methyl-amino]-2,2-dimethyl-propan-1-ol

Systemtic Name: 3-[[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-methyl-amino]-2,2-dimethyl-propan-1-ol Openeye Name: 3-[[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-methyl-amino]-2,2-dimethyl-propan-1-ol CAS Name: 3-[[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-methylamino]-2,2-dimethyl-1-propanol IUPAC Name: 3-[[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-methylamino]-2,2-dimethylpropan-1-ol Traditional Name: 3-[[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-methyl-amino]-2,2-dimethyl-propan-1-ol Formula: C18H30FN2O+ MolecularWeight: 309.442003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN(C)C1CCC[NH+](C1)CC2=CC=CC=C2F)CO

Isomeric SMILES

CC(C)(CN(C)[C@H]1CCC[NH+](C1)CC2=CC=CC=C2F)CO

InChI

InChI=1S/C18H29FN2O/c1-18(2,14-22)13-20(3)16-8-6-10-21(12-16)11-15-7-4-5-9-17(15)19/h4-5,7,9,16,22H,6,8,10-14H2,1-3H3/p+1/t16-/m0/s1