2-[(2S)-1-[[2-(4-methoxy-3-methyl-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-[[2-(4-methoxy-3-methyl-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-[[2-(4-methoxy-3-methyl-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-[[2-(4-methoxy-3-methylphenyl)-5-methyl-4-oxazolyl]methyl]-2-piperidin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-[[2-(4-methoxy-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-[[2-(4-methoxy-3-methyl-phenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-yl]ethanol Formula: C20H29N2O3+ MolecularWeight: 345.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCCC3CCO)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCC[C@H]3CCO)OC

InChI

InChI=1S/C20H28N2O3/c1-14-12-16(7-8-19(14)24-3)20-21-18(15(2)25-20)13-22-10-5-4-6-17(22)9-11-23/h7-8,12,17,23H,4-6,9-11,13H2,1-3H3/p+1/t17-/m0/s1