2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-(2-pyridinyl)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 2-(4-chlorophenyl)-5-methyl-4-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]oxazole Formula: C21H23ClN3O+ MolecularWeight: 368.87982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)C[NH+]3CCCCC3C4=CC=CC=N4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)C[NH+]3CCCC[C@H]3C4=CC=CC=N4

InChI

InChI=1S/C21H22ClN3O/c1-15-19(24-21(26-15)16-8-10-17(22)11-9-16)14-25-13-5-3-7-20(25)18-6-2-4-12-23-18/h2,4,6,8-12,20H,3,5,7,13-14H2,1H3/p+1/t20-/m0/s1