[4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol; 2-hydroxy-2-oxo-acetate CAS Name: [4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol; 2-hydroxy-2-oxoacetate IUPAC Name: [4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol; 2-hydroxy-2-oxoacetate Traditional Name: [4-(4-fluorophenyl)-1-methyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl]methanol binoxalate Formula: C15H18FNO5 MolecularWeight: 311.305523

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC=C(C(C1)CO)C2=CC=C(C=C2)F.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+]1CC=C(C(C1)CO)C2=CC=C(C=C2)F.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C13H16FNO.C2H2O4/c1-15-7-6-13(11(8-15)9-16)10-2-4-12(14)5-3-10;3-1(4)2(5)6/h2-6,11,16H,7-9H2,1H3;(H,3,4)(H,5,6)