[1-[(3-fluorophenyl)methyl]-4-oxidanyl-piperidin-1-ium-4-yl]methyl-propan-2-yl-azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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