diethyl-[(R)-(4-fluoranyl-3-methyl-phenyl)-piperidin-1-ium-4-yl-methyl]azanium

Systemtic Name: diethyl-[(R)-(4-fluoranyl-3-methyl-phenyl)-piperidin-1-ium-4-yl-methyl]azanium Openeye Name: diethyl-[(R)-(4-fluoro-3-methyl-phenyl)-piperidin-1-ium-4-yl-methyl]ammonium CAS Name: diethyl-[(R)-(4-fluoro-3-methylphenyl)-(4-piperidin-1-iumyl)methyl]ammonium IUPAC Name: diethyl-[(R)-(4-fluoro-3-methylphenyl)-piperidin-1-ium-4-ylmethyl]azanium Traditional Name: diethyl-[(R)-(4-fluoro-3-methyl-phenyl)-piperidin-1-ium-4-yl-methyl]ammonium Formula: C17H29FN2+2 MolecularWeight: 280.423963

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C1CC[NH2+]CC1)C2=CC(=C(C=C2)F)C

Isomeric SMILES

CC[NH+](CC)[C@H](C1CC[NH2+]CC1)C2=CC(=C(C=C2)F)C

InChI

InChI=1S/C17H27FN2/c1-4-20(5-2)17(14-8-10-19-11-9-14)15-6-7-16(18)13(3)12-15/h6-7,12,14,17,19H,4-5,8-11H2,1-3H3/p+2/t17-/m1/s1