[1-[(3-fluorophenyl)methyl]-4-oxidanyl-piperidin-1-ium-4-yl]methyl-propyl-azanium

Systemtic Name: [1-[(3-fluorophenyl)methyl]-4-oxidanyl-piperidin-1-ium-4-yl]methyl-propyl-azanium Openeye Name: [1-[(3-fluorophenyl)methyl]-4-hydroxy-piperidin-1-ium-4-yl]methyl-propyl-ammonium CAS Name: [1-[(3-fluorophenyl)methyl]-4-hydroxy-4-piperidin-1-iumyl]methyl-propylammonium IUPAC Name: [1-[(3-fluorophenyl)methyl]-4-hydroxypiperidin-1-ium-4-yl]methyl-propylazanium Traditional Name: [1-(3-fluorobenzyl)-4-hydroxy-piperidin-1-ium-4-yl]methyl-propyl-ammonium Formula: C16H27FN2O+2 MolecularWeight: 282.396783

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1(CC[NH+](CC1)CC2=CC(=CC=C2)F)O

Isomeric SMILES

CCC[NH2+]CC1(CC[NH+](CC1)CC2=CC(=CC=C2)F)O

InChI

InChI=1S/C16H25FN2O/c1-2-8-18-13-16(20)6-9-19(10-7-16)12-14-4-3-5-15(17)11-14/h3-5,11,18,20H,2,6-10,12-13H2,1H3/p+2