2-(2-fluorophenyl)-5-methyl-4-[[(3S)-3-phenylmethoxypiperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(2-fluorophenyl)-5-methyl-4-[[(3S)-3-phenylmethoxypiperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 4-[[(3S)-3-benzyloxypiperidin-1-ium-1-yl]methyl]-2-(2-fluorophenyl)-5-methyl-oxazole CAS Name: 2-(2-fluorophenyl)-5-methyl-4-[[(3S)-3-phenylmethoxy-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(2-fluorophenyl)-5-methyl-4-[[(3S)-3-phenylmethoxypiperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 4-[[(3S)-3-benzoxypiperidin-1-ium-1-yl]methyl]-2-(2-fluorophenyl)-5-methyl-oxazole Formula: C23H26FN2O2+ MolecularWeight: 381.463143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2F)C[NH+]3CCCC(C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2F)C[NH+]3CCC[C@@H](C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H25FN2O2/c1-17-22(25-23(28-17)20-11-5-6-12-21(20)24)15-26-13-7-10-19(14-26)27-16-18-8-3-2-4-9-18/h2-6,8-9,11-12,19H,7,10,13-16H2,1H3/p+1/t19-/m0/s1